Benzyl salicylate

  • Identifiers

    CAS mumber
    118-58-1

    Molecular formula
    C14H12O3

    SMILES
    C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2O

    Retention indicies (RI)

    • DB5: 1861.0
    • Carbowax: 2715.2

  • Properties

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

    Molecular weight
    228.24 g/mol

    Melting points

    • 75 °F (NTP, 1992)
    • 24 °C
    • 23.4 °C

    Boiling points

    • 406 °F at 26 mmHg (NTP, 1992)
    • 320 °C
    • BP: 211 °C at 2.67 kPa
    • 208.00 °C. @ 26.00 mm Hg

    Flash points

    • 180 °C (356 °F) - closed cup
    • >212 °F (>100 °C) - closed cup

    Solubilities

    • Slightly soluble (NTP, 1992)
    • In water, 8.8 mg/L at 20 °C, pH 6.8-7.1 /OECD Guideline 105 (Water Solubility)/
    • Slightly soluble in water
    • Miscible with alcohol or ether
    • Soluble in 9 vols of 90% alcohol
    • insoluble in water, glycerol; soluble in organic solvents, oils
    • miscible above 25� (in ethanol)

  • Synonyms

    • BENZYL SALICYLATE
    • 118-58-1
    • Benzyl 2-hydroxybenzoate
    • Benzyl o-hydroxybenzoate
    • Salicylic Acid Benzyl Ester
    • Salicylic acid, benzyl ester
    • Phenylmethyl 2-hydroxybenzoate
    • Benzoic acid, 2-hydroxy-, phenylmethyl ester
    • Salicylsaeurebenzylester
    • NSC 6647
    • Salicyclic acid, benzyl ester
    • FEMA No. 2151
    • CCRIS 4749
    • UNII-WAO5MNK9TU
    • WAO5MNK9TU
    • 2-Hydroxybenzoic acid phenylmethyl ester
    • EINECS 204-262-9
    • Salicyclic acid benzyl ester
    • BRN 2115365
    • 2-Hydroxybenzoic acid, phenylmethyl ester
    • DTXSID1024598
    • AI3-00517
    • NSC-6647
    • Salicylic acid-benzyl ester
    • DTXCID304598
    • HSDB 8387
    • EC 204-262-9
    • 4-10-00-00157 (Beilstein Handbook Reference)
    • CAS-118-58-1
    • Benzoic acid, hydroxy-, phenylmethyl ester
    • benzyl salicilate
    • Benzyle salicylate
    • MFCD00020034
    • Benzyl salicylate, 98%
    • WLN: QR BVO1R
    • Benzyl salicylate (Standard)
    • SCHEMBL15573
    • MLS002415718
    • BIDD:ER0019
    • BENZYL SALICYLATE [MI]
    • CHEMBL460124
    • BENZYL SALICYLATE [FCC]
    • BENZYL SALICYLATE [FHFI]
    • FEMA 2151
    • HY-B1556R
    • NSC6647
    • Benzyl salicylate, >=98%, FG
    • CHEBI:165211
    • HMS2268I12
    • 2-Hydroxybenzoic Acid Benzyl Ester
    • BENZYL SALICYLATE [WHO-DD]
    • HY-B1556
    • Tox21_201869
    • Tox21_303046
    • Benzyl salicylate, analytical standard
    • AKOS015915010
    • NCGC00091411-01
    • NCGC00091411-02
    • NCGC00091411-03
    • NCGC00256928-01
    • NCGC00259418-01
    • AC-11580
    • AS-12902
    • DA-51035
    • SMR000112465
    • DB-052255
    • Benzyl salicylate, purum, >=99.0% (GC)
    • CS-0013437
    • NS00005123
    • S0009
    • G74505
    • Q416929
    • Z19703595
    • 204-262-9
    • InChI=1/C14H12O3/c15-13-9-5-4-8-12(13)14(16)17-10-11-6-2-1-3-7-11/h1-9,15H,10H
1 3

Botanical

Name CAS Botanical Proportion
Basil (Comoro Islands) 1 8015-73-4 Ocimum basilicum L., fam. Lamiaceae (Labiatae) 0.2%
Easter Lily, Living Flower Headspace Lilium candidum L., fam. Liliaceae 3.1%
Easter Lily, Picked Flower Headspace A Lilium candidum L., fam. Liliaceae 1.0%
Easter Lily, Picked Flower Headspace B Lilium candidum L., fam. Liliaceae 0.05%
Massoia bark Cryptocaryo massoia, fam. Lauraceae 0.34%
Narcissus tazetta absolute 2 8023-75-4 Narcissus tazetta L., fam. Amaryllidaceae 0.1%
Ylang Ylang 4 8006-81-3 Cananga odorata (Lamk.) Hook. f. et Thomson forma genuina, fam. Annonaceae 2.01%
Ylang Ylang (China) 1 8006-81-3 Cananga odorata (Lamk.) Hook. f. et Thomson forma genuina, fam. Annonaceae 0.34%
Rosa rugosa Rosa rugosa Thunb., var. plena Regel, fam. Rosaceae 0.01%
Apple flower Malus arnoldiana (Rehd) Sarg. var. Redgold, fam. Rosaceae 0.01%
Hedychium coronarium flower (Japan) Hedychium coronarium Koenig, fam. Zingiberaceae 0.05%
Diospyros discolor, fruit peel Diospyros discolor Willd., Ebenaceae (D. blancoi), fam. Ebenaceae 26.9%
Ylang Ylang 2a 8006-81-3 Cananga odorata (Lamk.) Hook. f. et Thomson forma genuina, fam. Annonaceae 1.9%
Ylang Ylang 2b 8006-81-3 Cananga odorata (Lamk.) Hook. f. et Thomson forma genuina, fam. Annonaceae 5.2%
Ylang Ylang 2c 8006-81-3 Cananga odorata (Lamk.) Hook. f. et Thomson forma genuina, fam. Annonaceae 4.9%
Ylang Ylang 3 8006-81-3 Cananga odorata (Lamk.) Hook. f. et Thomson forma genuina, fam. Annonaceae 3.0%
Genet absolute 2 8023-80-1 Spartium junceum L., fam. Leguminosae (Papilionaceae) 0.01%
Daphne tangutica flower concrete (China) Daphne tangutica Maxim., fam. Thymelaeaceae 4.06%
Clerodendrum fragrans flower (China) Clerodendrum fragrans Vent., fam. Verbenaceae 0.26%
Ylang Ylang (China) 3 8006-81-3 Cananga odorata (Lamk.) Hook. f. et Thomson forma genuina, fam. Annonaceae 0.25%
Ylang Ylang (Laos) 8006-81-3 Cananga odorata (Lamk.) Hook. f. et Thomson forma genuina, fam. Annonaceae 0.28%
Ylang Ylang 5a 8006-81-3 Cananga odorata (Lamk.) Hook. f. et Thomson forma genuina, fam. Annonaceae 2.37%
Ylang Ylang (Colombia) 8006-81-3 Cananga odorata (Lamk.) Hook. f. et Thomson forma genuina, fam. Annonaceae 1.0%
Ylang Ylang 5b 8006-81-3 Cananga odorata (Lamk.) Hook. f. et Thomson forma genuina, fam. Annonacaea 2.63%
Ylang Ylang 5c 8006-81-3 Cananga odorata (Lamk.) Hook. f. et Thomson forma genuina, fam. Annonaceae 3.05%
Ylang Ylang 5d 8006-81-3 Cananga odorata (Lamk.) Hook. f. et Thomson forma genuina, fam. Annonaceae 2.81%
Alseuosmia macrophylla Alseuosmia macrophylla A. Cunn, fam. Alseuosmiaceae 9.4%
Fagraea berteriana flower Fagraea berteriana A. Gray ex Benth., fam. Potaliaceae 3.56%
Honeysuckle, japanese Lonicera japonica L., fam. Caprifoliaceae 0.01%
Jasmine rose absolute (India) Gardenia jasminoides Ellis, fam. Rubiaceae 0.48%
Jasmine (China) 2b (absolute) 8022-96-6 Jasminum officinale var. grandiflorum L., fam. Oleaceae 0.15%
Narcissus tazetta (var. chinensis) 8023-75-4 Narcissus tazetta L., var. chinensis, fam. Amaryllidaceae 0.17%
Tulip sylvestre Tulipa sylvestris L., fam. Liliaceae 0.01%
Tulip sylvestre headspace cv. "Lack van Rijn" Tulipa sylvestris L. cultivar "Lack van Rijn", fam. Liliaceae 0.01%
Cinnamomum cordatum (Malaysia) 1a leaf Cinnamomum cordatum Kosterm., fam. Lauraceae 4.7%
Pinus sylvestris 8 8023-99-2 Pinus sylvestris L. (Scotch pine), fam. Pinaceae 0.05%
Pinus sylvestris (Lithuania) 8023-99-2 Pinus sylvestris L. (Scotch pine), fam. Pinaceae 0.05%
Desmos goezeanus leaf (Australia) Desmos goezeanus (F. Muell.) L.W. Jessup, fam. Annonaceae 30.25%
Aniba riparia (Brazil) 1a leaf Aniba riparia (Nees) Mez, fam. Lauraceae 2.1%
Aniba riparia (Brazil) 1b branch Aniba riparia (Nees) Mez, fam. Lauraceae 9.5%
Aniba riparia (Brazil) 1c bark wood Aniba riparia (Nees) Mez, fam. Lauraceae 7.9%
Aniba riparia (Brazil) 1d trunk wood Aniba riparia (Nees) Mez, fam. Lauraceae 7.7%
Pinus canariensis (Spain-Tenerife) Pinus canariensis Sweet ex Sprengel, fam. Pinaceae 0.01%