Toluene

  • Identifiers

    CAS mumber
    108-88-3

    Molecular formula
    C7H8

    SMILES
    CC1=CC=CC=C1

    Retention indicies (RI)

    • DB5: 771.0
    • Carbowax: 1033.29

  • Properties

    XLogP3-AA
    2.7 Well soluble in DEP, BB, MMB

    Molecular weight
    92.14 g/mol

    Melting points

    • -139 °F (NTP, 1992)
    • -94.9 °C
    • -94.9 °C
    • -95 °C
    • -95 °C
    • -139 °F
    • -139 °F

    Boiling points

    • 231.1 °F at 760 mmHg (NTP, 1992)
    • 110.6 °C
    • 110.6 °C
    • 110.00 to 111.00 °C. @ 760.00 mm Hg
    • 111 °C
    • 232 °F
    • 232 °F

    Flash points

    • 40 °F (NTP, 1992)
    • 4.4 °C
    • 4.0 °C (39.2 °F) - closed cup
    • 4.4 dec C (closed cup)
    • 40 °F (4 °C) (Closed cup)
    • 4 °C c.c.
    • 40 °F
    • 40 °F

    Solubilities

    • less than 1 mg/mL at 64 °F (NTP, 1992)
    • 526 mg/L (at 25 °C)
    • In water, 526 mg/L at 25 °C
    • Miscible with alcohol, chloroform, ether, acetone, glacial acetic acid, carbon disulfide
    • Soluble in ethanol, benzene, diethyl ether, acetone, chloroform, glacial acetic acid and carbon disulfide
    • 0.526 mg/mL at 25 °C
    • Solubility in water: none
    • (74 °F): 0.07%

  • Synonyms

    • toluene
    • methylbenzene
    • 108-88-3
    • toluol
    • Phenylmethane
    • methacide
    • methylbenzol
    • Benzene, methyl-
    • antisal 1a
    • Toluen
    • tolu-sol
    • Methane, phenyl-
    • Tolueen
    • Toluolo
    • phenyl methane
    • 1-Methylbenzene
    • monomethyl benzene
    • RCRA waste number U220
    • Tolueno
    • methyl-Benzene
    • Caswell No. 859
    • p-toluene
    • NCI-C07272
    • CP 25
    • CCRIS 2366
    • HSDB 131
    • NSC 406333
    • UN 1294
    • 4-methylbenzene
    • Benzene, methyl
    • EINECS 203-625-9
    • UNII-3FPU23BG52
    • EPA Pesticide Chemical Code 080601
    • NSC-406333
    • 3FPU23BG52
    • DTXSID7021360
    • CHEBI:17578
    • TOLUENE-3,5-D2
    • AI3-02261
    • MFCD00008512
    • CHEMBL9113
    • DTXCID501360
    • EC 203-625-9
    • Toluene, anhydrous
    • NCGC00090939-02
    • TOLUENE (IARC)
    • TOLUENE [IARC]
    • TOLUENE (MART.)
    • TOLUENE [MART.]
    • TOLUENE (USP-RS)
    • TOLUENE [USP-RS]
    • Tolueen [Dutch]
    • Toluen [Czech]
    • Toluene, analytical standard
    • Tolueno [Spanish]
    • Toluolo [Italian]
    • TOLUENE (RING-D5)
    • Toluene (Ring-D5, 98%)
    • methyl benzene
    • para-toluene
    • Methyl benzol
    • Toluene, ACS reagent, >=99.5%
    • Toluene 1000 microg/mL in Methanol
    • CAS-108-88-3
    • RAMIPRIL IMPURITY G (EP IMPURITY)
    • RAMIPRIL IMPURITY G [EP IMPURITY]
    • PHME
    • TOLUENE (RING-13C6, 99%)
    • UN1294
    • RCRA waste no. U220
    • methylbenzenes
    • Dracyl
    • phenyl-methane
    • toluene solvent
    • 2-methylbenzene
    • toluene-
    • Methylbenzene; Toluene; Ramipril Imp. G (EP); Ramipril Impurity G
    • MePh
    • 2-methyl benzene
    • 4-methyl-benzene
    • Toluene ACS Grade
    • Toluene-13C
    • Toluene HPLC grade
    • Methylbenzene, 9CI
    • Toluene (Technical)
    • Toluene, for HPLC
    • PhCH3
    • Toluene, ACS reagent
    • Toluene, HPLC Grade
    • 4i7k
    • TOLUENE [HSDB]
    • Toluene, 99.5%
    • TOLUENE [MI]
    • CP 25 (SOLVENT)
    • Toluene, Environmental Grade
    • Toluene, Semiconductor Grade
    • Toluene, LR, >=99%
    • C6H5CH3
    • TOLUENE [GREEN BOOK]
    • WLN: 1R
    • BIDD:ER0288
    • Toluene, anhydrous, 99.8%
    • Toluene, ASTM, 99.5%
    • Toluene, p.a., 99.5%
    • GTPL5481
    • Toluene, AR, >=99.5%
    • Toluene, for HPLC, 99.9%
    • Toluene, LR, rectified, 99%
    • CHEBI:38975
    • DTXSID50175878
    • Toluene (Methyl-13C, 99%)
    • Toluene, HPLC grade, 99.8%
    • Toluene, Spectrophotometric Grade
    • Toluene 10 microg/mL in Methanol
    • Toluene, LR, sulfur free, 99%
    • Toluene, AR, rectified, 99.5%
    • Toluene, technical grade, 95.0%
    • BCP16202
    • GAA93323
    • MLA39935
    • RAA95438
    • Toluene, for HPLC, >=99.8%
    • Toluene, for HPLC, >=99.9%
    • Toluene, histology grade, practical
    • Toluene 100 microg/mL in Methanol
    • Tox21_111042
    • Tox21_201224
    • BDBM50008558
1 3

Botanical

Name CAS Botanical Proportion
Carrot seed (France) 1 8015-88-1 Daucus carota L., fam. Apiaceae (Umbelliferae) 0.01%
Ginger (Australia) 1 8007-08-7 Zingiber officinale Roscoe, fam. Zingiberaceae 0.15%
Ginger (India) 3 8007-08-7 Zingiber officinale Roscoe, fam. Zingiberaceae 0.09%
Lemon balm 4 ssp. altimissia 8014-71-9 Melissa officinalis L. ssp.altissima (Sibthr. et Smith) Arcang., Lamiaceae 0.5%
Mentha spicata (Greece) Chemotype I Mentha spicata L. (Chemotype I), fam. Lamiaceae (Labiatae) 0.01%
Myrtle leaf (Morocco) 1 8008-46-6 Myrtus communis L., fam. Myrtaceae 0.05%
Etrog, peel Citrus medica L., cultivar ethrog Engl., fam. Rutaceae 0.01%
Guava fruit (Nigeria) 91770-12-6 Psidium guajava L., fam. Myrtaceae 8.27%
Cilantro (Coriander leaf) 1 8008-52-4 Coriandrum sativum L., fam. Apiaceae (Umbelliferae) 1.17%
Tagetes 2 8016-84-0 Tagetes minuta L. (Marigold), fam. Asteraceae (Compositae) 0.02%
Thyme red (Spain) 3 8007-46-3 Thymus zygis L., fam. Lamiaceae (Labiatae) 0.01%
Pear (Japan), Asian Pyrus serotina Rehder (Asian pear), cultivar Chojui, fam. Rosaceae 4.03%
Agarwood smoke 1 Aquilaria agallocha Roxb., fam. Thymelaeaceae 0.12%
Agarwood smoke 2 Aquilaria agallocha Roxb., fam. Thymelaeaceae 0.19%
Lemon leaf (petitgrain) 2 84929-31-7 Citrus limon (L.) Burm. f., fam. Rutaceae 0.01%
Lemon leaf (petitgrain) (Russia) 84929-31-7 Citrus limon (L.) Burm. f., fam. Rutaceae 0.02%
Meyer lemon leaf (Russia) 1 Citrus limon x Citrus sinensis, fam. Rutaceae 0.06%
Ylang Ylang (China) 2a 8006-81-5 Cananga odorata (Lamk.) Hook. f. et Thomson forma genuina, fam. Annonaceae 2.92%
Mimusops elengi flower headspace Mimusops elengi L., fam. Sapotaceae 0.4%
Dill herb (Cuba) 8006-75-5 Anethum graveolens L., fam. Apiaceae (Umbelliferae) 0.05%
Hedyotis diffusa (Malaysia) Hedyotis diffusa Willd. (syn. Oldenlandia diffusa Roxb.), fam. Rubiaceae 0.3%
Bitter orange flower headspace (China) Citrus aurantium L., ssp. amara Engl., fam. Rutaceae 0.1%
Phaeomeria speciosa Phaeomeria speciosa Koord., (Etlingera elatior (Jack) R.M. Smith), Zingib. 0.1%
Dill herb (Reunion Island) 8006-75-5 Anethum graveolens L., fam. Apiaceae (Umbelliferae) 0.2%
Kewda (India) Pandanus fascicularis Lam., var. fascilarris, fam. Pandanaceae 0.01%
Curcuma aromatica (India) 2a leaf Curcuma aromatica Salisb., fam. Zingiberaceae 0.05%
Turmeric (Bhutan) 1b leaf 8024-37-1 Curcuma longa L. (C. domestica Val.), fam. Zingiberaceae 0.05%
Chicory root, roasted 1a 68650-43-1 Cichorium intybus L., fam. Asteraceae (Compositae) 0.01%
Chicory root, roasted 1b 68650-43-1 Cichorium intybus L., fam. Asteraceae (Compositae) 0.07%
Carob bean extract 1 9000-40-2 Ceratonia siliqua L., fam. Leguminoseae 0.05%
Eucalyptus dives (Rwanda) 90028-48-1 Eucalyptus dives Schau., fam. Myrtaceae 0.01%
Truffle, Asian Tuber indicum Cooke et Mass. (T. himalayense Zhang-Minter),fam.Ascomycetae 1.0%
Patchouli (China) 3a root 8014-09-3 Pogostemon cablin Benth., fam. Lamiaceae (Labiatae) 0.02%
Patchouli (China) 3b rhizome 8014-09-3 Pogostemon cablin Benth., fam. Lamiaceae (Labiatae) 0.05%
Asafoetida headspace 9000-04-8 Ferula assafoetida L., fam. Apiaceae (Umbelliferae) 0.01%