AG009ASN

134615-22-8 | (S)-1-(3-Bromophenyl)ethanol

AG009ASN

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CAS Number	134615-22-8
Catalog Number	AG009ASN(AGN-PC-0PKDCN)
Chemical Name	(S)-1-(3-Bromophenyl)ethanol
IUPAC Name	(1S)-1-(3-bromophenyl)ethanol
InChI	InChI=1S/C8H9BrO/c1-6(10)7-3-2-4-8(9)5-7/h2-6,10H,1H3/t6-/m0/s1
InChI Key	ULMJQMDYAOJNCC-LURJTMIESA-N
MDL Number	MFCD06201859
Molecular Formula	C8H9BrO
Molecular Weight	201.0605
SMILES	C[C@H](O)C1=CC=CC(Br)=C1
Synonyms	(S)-1-(3-BROMOPHENYL)ETHANOL, 134615-22-8, (1S)-1-(3-bromophenyl)ethan-1-ol, (1S)-1-(3-bromophenyl)ethanol, AC1OCVGB, AC1Q29MM, SCHEMBL852720, CTK5I8302, ULMJQMDYAOJNCC-LURJTMIESA-N, ZINC404020, KS-00000LN9, ANW-63982, MFCD06201859, SC1263, AKOS010603347, MCULE-8996999992, NE25047, AJ-22196, BC005067, CJ-03934, DS-16104, ZB013342, TC-152727, FT-0605600, ST24035718, (S)-(-)-1-(3-CHLOROPHENYL)ETHANOL, EN300-66858, (S)-3-Bromo-alpha-methylbenzyl alcohol, 95%, 98% ee, I14-106887, Z803153180, -1- ETHANOL, (S)-1-(3-Chlorophenyl)ethanol, (1S)-1-(3-chlorophenyl)ethanol, NSC143363, (S)-3-Bromo-??-methylbenzyl alcohol, (1S)-1-(3-chlorophenyl)ethan-1-ol, CID6951261, (S)-3-Bromo-alpha-methylbenzyl alcohol,

Complexity	105
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	199.984g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	201.063g/mol
Monoisotopic Mass	199.984g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302+H312+H332-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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