AG002VYA

286440-92-4 | Benzeneethanol, 3,4-difluoro-

AG002VYA

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CAS Number	286440-92-4
Catalog Number	AG002VYA(AGN-PC-0KKMF0)
Chemical Name	Benzeneethanol, 3,4-difluoro-
IUPAC Name	2-(3,4-difluorophenyl)ethanol
InChI	InChI=1S/C8H8F2O/c9-7-2-1-6(3-4-11)5-8(7)10/h1-2,5,11H,3-4H2
InChI Key	LQIZHIYYOQHWNF-UHFFFAOYSA-N
MDL Number	MFCD00143061
Molecular Formula	C8H8F2O
Molecular Weight	158.1453
SMILES	FC1=CC=C(CCO)C=C1F
Synonyms	2-(3,4-difluorophenyl)ethanol, 286440-92-4, 2-(3,4-difluorophenyl)ethan-1-ol, 3,4-Difluorophenethyl alcohol, BENZENEETHANOL, 3,4-DIFLUORO-, Benzeneethanol, 3,4-difluoro- (9CI), AC1MBXVI, 3,4-Difluorophenethanol, 3,4-Difluorophenethylalcohol, SCHEMBL1238835, CTK4G1822, 2-(3,4-difluorophenyl) ethanol, DTXSID60374274, LQIZHIYYOQHWNF-UHFFFAOYSA-N, 2-(3,4-difluoro-phenyl)-ethanol, JRD-2010, ZINC4255270, CL9076, MFCD00143061, SBB087275, AKOS012097217, MCULE-8074742835, NE23111, KS-0000100Z, AS-46200, SC-98091, AB0033878, FT-0691213, X7944, Z1446856030, C8H8F2O, ZINC04255270, CID2758313,

Complexity	119
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	158.054g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	158.148g/mol
Monoisotopic Mass	158.054g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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