Ethylbenzene

  • Identifiers

    CAS mumber
    100-41-4

    Molecular formula
    C8H10

    SMILES
    CCC1=CC=CC=C1

    Retention indicies (RI)

    • DB5: 856.0
    • Carbowax: 1129.4

  • Properties

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

    Molecular weight
    106.16 g/mol

    Melting points

    • -139 °F (NTP, 1992)
    • -94.95 °C
    • -139 °F
    • -139 °F

    Boiling points

    • 277.2 °F at 760 mmHg (NTP, 1992)
    • 136.2 °C
    • 277 °F
    • 277 °F

    Flash points

    • 59 °F (NTP, 1992)
    • 12.8 °C
    • 15.0 °C (59.0 °F) - closed cup
    • 64 °F (18 °C) - closed cup
    • 70 °F (21 °C) - closed cup
    • 55 °F
    • 55 °F

    Solubilities

    • less than 1 mg/mL at 73 °F (NTP, 1992)
    • In water, 170 mg/L at 25 °C (average of 16 literature ranging from 131-212 mg/L at 25 °C)
    • In water, 169 mg/L at 25 °C
    • In water, 0.014 g/100 mL at 15 °C
    • Soluble in all proportions in ethyl alcohol and ethyl ether
    • For more Solubility (Complete) data for ETHYLBENZENE (8 total), please visit the HSDB record page.
    • 0.01%

  • Synonyms

    • ETHYLBENZENE
    • 100-41-4
    • Phenylethane
    • Benzene, ethyl-
    • Ethylbenzol
    • Ethyl benzene
    • Aethylbenzol
    • Ethylenzene
    • Ethylbenzeen
    • Etilbenzene
    • Etylobenzen
    • alpha-Methyltoluene
    • 1-ethylbenzene
    • NCI-C56393
    • HSDB 84
    • CCRIS 916
    • NSC 406903
    • EINECS 202-849-4
    • UNII-L5I45M5G0O
    • L5I45M5G0O
    • .alpha.-Methyltoluene
    • DTXSID3020596
    • ETHYL-BENZENE
    • CHEBI:16101
    • AI3-09057
    • EB
    • NSC-406903
    • DTXCID10596
    • CHEMBL371561
    • EC 202-849-4
    • 20302-26-5
    • ETHYL-ALPHA,ALPHA-D2-BENZENE-D5
    • ETHYLBENZENE (IARC)
    • ETHYLBENZENE [IARC]
    • ETHYLBENZENE (USP-RS)
    • ETHYLBENZENE [USP-RS]
    • Ethylbenzeen [Dutch]
    • Etylobenzen [Polish]
    • 158507-69-8
    • Aethylbenzol [German]
    • Etilbenzene [Italian]
    • UN1175
    • etph
    • 1-phenylethane
    • PYJ
    • EINECS 272-685-6
    • MFCD00011647
    • ETHYLBENZENE [MI]
    • Ethylbenzene [UN1175] [Flammable liquid]
    • ETHYLBENZENE [HSDB]
    • WLN: 2R
    • BIDD:ER0246
    • ghl.PD_Mitscher_leg0.1024
    • NSC 406903, Phenylethane
    • QSPL 092
    • Ethylbenzene, analytical standard
    • Ethylbenzene, anhydrous, 99.8%
    • NCI C56393
    • Tox21_201064
    • BDBM50167951
    • Ethylbenzene, ReagentPlus(R), 99%
    • NSC406903
    • STL282714
    • AKOS000120140
    • UN 1175
    • MSK000014-1000M
    • NCGC00090768-01
    • NCGC00090768-02
    • NCGC00258617-01
    • BS-18982
    • CAS-100-41-4
    • Ethylbenzene 10 microg/mL in Cyclohexane
    • Ethylbenzene 100 microg/mL in Cyclohexane
    • DB-045168
    • E0064
    • NS00009164
    • S0646
    • Ethylbenzene Solution in Methanol, 1000ug/mL
    • C07111
    • Q409184
    • F0001-0016
    • Z104473632
    • Ethylbenzene, United States Pharmacopeia (USP) Reference Standard
    • InChI=1/C8H10/c1-2-8-6-4-3-5-7-8/h3-7H,2H2,1H
    • Ethylbenzene, Pharmaceutical Secondary Standard; Certified Reference Material
    • 202-849-4
1 3

Botanical

Name CAS Botanical Proportion
Etrog, leaf Citrus medica L., cultivar ethrog Engl., fam. Rutaceae 0.01%
Etrog, peel Citrus medica L., cultivar ethrog Engl., fam. Rutaceae 0.01%
Guava fruit (Nigeria) 91770-12-6 Psidium guajava L., fam. Myrtaceae 0.34%
Osmanthus concentrate 2 (Sukhumi-Abkhasia) 68917-05-5 Osmanthus fragrans (Thunb.) Lour., fam. Oleaceae 0.02%
Litsea zeylanica Litsea zeylanica Nees, fam. Lauraceae 0.01%
Litchi pulp (China) Lichi sinensis Sonn., fam. Sapindaceae 0.17%
Indian curry leaf tree (leaf) Murraya koenigii Spreng., fam. Rutaceae 0.01%
Fitweed root Eryngium foetidum L., fam. Apiaceae (Umbelliferae) 0.29%
Rue (China) 2 8014-29-7 Ruta graveolens L., fam. Rutaceae 0.02%
Cordia nitida fruit Cordia nitida Vahl., fam. Borraginaceae 0.5%
Patchouli (China) 3a root 8014-09-3 Pogostemon cablin Benth., fam. Lamiaceae (Labiatae) 0.01%
Patchouli (China) 3b rhizome 8014-09-3 Pogostemon cablin Benth., fam. Lamiaceae (Labiatae) 0.02%
Alstonia scholaris Alstonia scholaris (L.) R.Br., fam. Apocynaceae 0.5%
Ambarella fruit (Brazil) Spondias cytherea Sonnerat, fam. Anarcardiaceae 0.05%
Eugenia catharinensis leaf (Brazil) Eugenia catharinensis D. Legrand, fam. Myrtaceae 0.8%