Benzeneacetonitrile, a-hydroxy-4-methoxy-

Modify Date: 2025-09-21 11:45:53

Benzeneacetonitrile, a-hydroxy-4-methoxy- structure	Common Name	Benzeneacetonitrile, a-hydroxy-4-methoxy-
	CAS Number	33646-40-1	Molecular Weight	163.17300
	Density	1.183g/cm3	Boiling Point	334.4ºC at 760mmHg
	Molecular Formula	C₉H₉NO₂	Melting Point	N/A
	MSDS	N/A	Flash Point	156.1ºC

Name	2-hydroxy-2-(4-methoxyphenyl)acetonitrile
Synonym	More Synonyms

Density	1.183g/cm3
Boiling Point	334.4ºC at 760mmHg
Molecular Formula	C₉H₉NO₂
Molecular Weight	163.17300
Flash Point	156.1ºC
Exact Mass	163.06300
PSA	53.25000
LogP	1.25218
Index of Refraction	1.55
InChIKey	WLDAAMXETLHTER-UHFFFAOYSA-N
SMILES	COc1ccc(C(O)C#N)cc1

CHEMICAL IDENTIFICATION

RTECS NUMBER :: OO8500000

CHEMICAL NAME :: Mandelonitrile, p-methoxy-

CAS REGISTRY NUMBER :: 33646-40-1

BEILSTEIN REFERENCE NO. :: 1368117

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C9-H9-N-O2

MOLECULAR WEIGHT :: 163.19

WISWESSER LINE NOTATION :: NCYQR DO1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 25 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: AD277-689

HS Code	2926909090

HS Code	2926909090
Summary	HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

MANDELONITRILE,p-METHOXY

p-Methoxybenzaldehyde cyanohydrin

Benzaldehyde cyanohydrin-p-methoxy

EINECS 251-614-2

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Product Name: Benzeneacetonitrile, a-hydroxy-4-methoxy-
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