Benzoin

Catalog Number	ACM119539-3
CAS	119-53-9
Structure
IUPAC Name	2-hydroxy-1,2-diphenylethanone
Synonyms	α-Hydroxybenzyl phenyl ketone, α-Hydroxy-α-phenylacetophenone, 2-Hydroxy-2-phenylacetophenone
Molecular Weight	212.24
Molecular Formula	C14H12O2
Canonical SMILES	OC(c1ccccc1)C(=O)c2ccccc2
InChI	1S/C14H12O2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10,13,15H
InChI Key	ISAOCJYIOMOJEB-UHFFFAOYSA-N
Boiling Point	194 °C/12 mmHg (lit.)
Melting Point	134-136°C
Flash Point	154.8°C
Density	1.31
Solubility	less than 0.1 mg/mL at 64° F (NTP, 1992);0.00 M;0.3 mg/mL at 25 °C;SOL IN WARM ALCOHOL & CARBON DISULFIDE; INSOL IN WATER;0.3 mg/mL at 25 °C;Solubility in water, g/100ml: 0.03;insoluble in water; slightly soluble in hot water, oils;slightly soluble (in ethanol)
Appearance	Light yellow powder or crystals with a camphor-like odour
Application	This product is suitable for scientific research.
Color Form	PALE YELLOW CRYSTALS;WHITE CRYSTALS;REDDISH-BROWN GLOBULES
Complexity	225
Covalently-Bonded Unit Count	1
EC Number	204-331-3
Exact Mass	212.083725
Heavy Atom Count	16
Log P	2.13
MDL Number	MFCD00004496
Monoisotopic Mass	212.08373g/mol
NSC Number	8082
Odor	SWEET NON-DESCRIPT ODOR;VANILLA-LIKE ODOR
PSA	37.30000
Quality Level	100
Refractive Index	1.609
Rotatable Bond Count	3
RTECS Number	DI1590000
Stability	Stable. Combustible. Incompatible with strong oxidizing agents.
Vapor Pressure	0.0±0.8 mmHg at 25°C
X Log P3	2.1

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