AG00201Y

174913-11-2 | Benzene, 1-bromo-2-chloro-3-methoxy-

AG00201Y

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CAS Number	174913-11-2
Catalog Number	AG00201Y(AGN-PC-040QBY)
Chemical Name	Benzene, 1-bromo-2-chloro-3-methoxy-
IUPAC Name	1-bromo-2-chloro-3-methoxybenzene
InChI	InChI=1S/C7H6BrClO/c1-10-6-4-2-3-5(8)7(6)9/h2-4H,1H3
InChI Key	XOZKQZFQBFNXPW-UHFFFAOYSA-N
MDL Number	MFCD16036127
Molecular Formula	C7H6BrClO
Molecular Weight	221.4789
SMILES	COC1=C(Cl)C(Br)=CC=C1
Synonyms	1-Bromo-2-chloro-3-methoxybenzene, 174913-11-2, 3-Bromo-2-chloroanisole, bromochloro-anisole, 2-chloro-3-bromoanisole, SCHEMBL332274, ACMC-209e90, CTK4D5128, DTXSID10632578, XOZKQZFQBFNXPW-UHFFFAOYSA-N, ANW-22738, MFCD16036127, ZINC65337268, AKOS015834926, AS03120, FCH1391572, Benzene, 1-bromo-2-chloro-3-methoxy-, AK-63359, AS-46263, SY027066, AB0067615, AJ-115065, AX8212297, TR-035928, V3807, MFCD16036127 (95%), B-3810, I01-10683, C7H6BrClO,

Complexity	110
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	219.929g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	221.478g/mol
Monoisotopic Mass	219.929g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	9.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number