Benzyl benzoate (adulteration)

  • Identifiers

    CAS number
    120-51-4

    Molecular formula
    C14H12O2

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

  • Odor profile

    balsamic 81.65%
    fruity 72.54%
    sweet 66.0%
    herbal 58.8%
    floral 52.93%
    green 42.2%
    spicy 39.9%
    rose 39.73%
    cherry 38.25%
    oily 38.09%

    Scent© AI

  • Properties

    XLogP3-AA
    4.0 Well soluble in BB, DEP, IPM

    Molecular weight
    212.24 g/mol

    Melting points

    • 21 °C
    • 19 °C

    Boiling points

    • 323.5 °C
    • 321.3 °C
    • BP: 323-324 °C
    • 323.00 to 324.00 °C. @ 760.00 mm Hg
    • 324 °C

    Flash points

    • 148 °C
    • 158 °C (316 °F) - closed cup
    • 298 °F (148 °C) - closed cup

    Solubilities

    • 15.4 mg/L
    • Insoluble in water
    • Insoluble in glycerol; miscible with alcohol, chloroform, ether, oils
    • Soluble in ethanol, ethyl ether, acetone, benzene, methanol, chloroform
    • 1.98e-02 g/L
    • Solubility in water: none
    • insoluble in water; soluble in organic solvents, oils
    • miscible at room temperature (in ethanol)

  • Synonyms

    • BENZYL BENZOATE
    • 120-51-4
    • Benzoic acid, phenylmethyl ester
    • Ascabiol
    • Benylate
    • Benzoic acid benzyl ester
    • Scabiozon
    • Benzoic acid, benzyl ester
    • Novoscabin
    • Scabitox
    • Scobenol
    • Phenylmethyl benzoate
    • Ascabin
    • Scabagen
    • Benzyl phenylformate
    • Benzylets
    • Colebenz
    • Peruscabin
    • Scabanca
    • Scabide
    • Vanzoate
    • Benzyl benzenecarboxylate
    • benzylbenzoate
    • Antiscabiosum
    • Venzonate
    • Benzylis benzoas
    • Peruscabina
    • Benzylbenzenecarboxylate
    • Benzyl alcohol benzoic ester
    • Benzylum benzoicum
    • BENZYL-D5 BENZOATE
    • Benzoesaeurebenzylester
    • FEMA Number 2138
    • Benzyl benzoate (natural)
    • Benzylester kyseliny benzoove
    • NSC 8081
    • BENZOIC ACID PHENYLMETHYLESTER
    • Acarobenzyl
    • FEMA No. 2138
    • Benzevan
    • HSDB 208
    • NSC-8081
    • EINECS 204-402-9
    • EPA Pesticide Chemical Code 009501
    • UNII-N863NB338G
    • BRN 2049280
    • DTXSID8029153
    • CHEBI:41237
    • AI3-00523
    • N863NB338G
    • 347840-01-1
    • MFCD00003075
    • Benzyl benzoate [USP:JAN]
    • CHEMBL1239
    • BENZYLOXY PHENYL KETONE
    • DTXCID809153
    • EC 204-402-9
    • 4-09-00-00307 (Beilstein Handbook Reference)
    • NCGC00094981-03
    • Benzyl benzoate (USP:JAN)
    • BENZYL BENZOATE (II)
    • BENZYL BENZOATE [II]
    • BENZYL BENZOATE (MART.)
    • BENZYL BENZOATE [MART.]
    • Caswell No. 082
    • BENZYL BENZOATE (USP-RS)
    • BENZYL BENZOATE [USP-RS]
    • Acarosan
    • Venzoate
    • BENZYL BENZOATE (EP IMPURITY)
    • BENZYL BENZOATE [EP IMPURITY]
    • BENZYL BENZOATE (EP MONOGRAPH)
    • BENZYL BENZOATE (USP IMPURITY)
    • BENZYL BENZOATE [EP MONOGRAPH]
    • BENZYL BENZOATE [USP IMPURITY]
    • BENZYL BENZOATE (USP MONOGRAPH)
    • BENZYL BENZOATE [USP MONOGRAPH]
    • Benzoate de benzyle
    • BZM
    • CAS-120-51-4
    • SMR000471875
    • Benzylester kyseliny benzoove [Czech]
    • Bengal
    • benzyl-benzoate
    • Benzyl benzoat
    • 1dzm
    • Benylate (TN)
    • Benzoesaurebenzylester
    • Spectrum_001240
    • Benzoic acid-benzyl ester
    • Spectrum2_000532
    • Spectrum3_001757
    • Spectrum4_000773
    • Spectrum5_001128
    • WLN: RVO1R
    • Benzyl benzoate (Standard)
    • Benzyl benzoate, >=99%
    • SCHEMBL3038
    • BENZYL BENZOATE [MI]
    • BSPBio_003494
    • KBioGR_001186
    • KBioSS_001720
    • MLS001066412
    • MLS001336003
    • MLS001336004
    • BENZYL BENZOATE [FCC]
    • BENZYL BENZOATE [JAN]
    • DivK1c_000204
    • SPECTRUM1503002
    • SPBio_000543
    • Benzyl benzoate (JP17/USP)
    • BENZYL BENZOATE [FHFI]
    • BENZYL BENZOATE [HSDB]
    • BENZOIC ACID,BENZYL ESTER
    • HMS500K06
    • HY-B0935R
    • KBio1_000204
    • KBio2_001720
    • KBio2_004288
    • KBio2_006856
    • KBio3_002714
    • BENZYL BENZOATE [WHO-DD]
    • BENZYL BENZOATE [WHO-IP]
    • NSC8081
    • NINDS_000204
    • HMS1921P16
    • HMS2092F20
    • HMS2269D24
1 4

Botanical

Name CAS Botanical Proportion
Parsley seed 1 8000-68-8 Petroselinum crispum (Miller) A.W. Hill (P. sativum Hoffm.), fam. Apiaceae 25.0%