AG00ID0B

791136-88-4 | 3-Bromo-2-methoxybenzamide

AG00ID0B

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CAS Number	791136-88-4
Catalog Number	AG00ID0B(AGN-PC-0WD4M0)
Chemical Name	3-Bromo-2-methoxybenzamide
IUPAC Name	3-bromo-2-methoxybenzamide
InChI	InChI=1S/C8H8BrNO2/c1-12-7-5(8(10)11)3-2-4-6(7)9/h2-4H,1H3,(H2,10,11)
InChI Key	OTBLXJXQCXWEFG-UHFFFAOYSA-N
MDL Number	MFCD18391870
Molecular Formula	C8H8BrNO2
Molecular Weight	230.0586
SMILES	O=C(N)C1=CC=CC(Br)=C1OC
Synonyms	3-Bromo-2-methoxybenzamide, 791136-88-4, SCHEMBL257298, MFCD18391870, ZINC95930646, AK145902, AJ-136502, FT-0725249, A1-12182,

Complexity	174
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	228.974g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	230.061g/mol
Monoisotopic Mass	228.974g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	52.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

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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