Benzyl formate
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Benzyl formate
structure -
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CAS No:
104-57-4
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Formula:
C8H8O2
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Chemical Name:
Benzyl formate
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Synonyms:
Formic acid,phenylmethyl ester;Formic acid,benzyl ester;Benzyl formate;Benzyl methanoate;Benzyl alcohol,formate;NSC 8049
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CAS No:
Description
colourless liquid with an intense pleasant, floral-fruity odour
Benzylformate is a carboxylic ester. It derives from a benzyl alcohol.
Benzyl formate Basic Attributes
136.15
136.15
2041319
203-214-4
79GJF97O0Y
8049
DTXSID5059298
2915120000
Characteristics
26.3
1.6
colourless liquid with an intense pleasant, floral-fruity odour
1.1±0.1 g/cm3
4ºC
203 °C
180 °F
1.511
Insoluble in water, soluble in organic solvents, oils.
0.273mmHg at 25°C
Oral-rat LD50: 1400 mg/kg; Skin-rabbit LD50: 2000 mg/kg
Flammable; burning produces irritating fumes; may cause anesthesia to people at high concentrations
Safety Information
NA 1993 / PGIII
1
21/22
36-36/37-23
LQ5400000
Xn
Ventilated, low temperature and dry
P280
H302 + H312
|Warning|H302 (99.94%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 1699 companies from 8 notifications to the ECHA C&L Inventory.
Benzyl formate Use and Manufacturing
From benzyl alcohol and formate.
Solvent for cellulose esters; in perfumery.
Formic acid, phenylmethyl ester: ACTIVE
Food additives -> Flavoring Agents|Flavoring Agents -> JECFA Flavorings Index
Flavoring Agents
Computed Properties
Molecular Weight:136.15
XLogP3:1.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:136.052429494
Monoisotopic Mass:136.052429494
Topological Polar Surface Area:26.3
Heavy Atom Count:10
Complexity:95.4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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