AG003GOI

103448-24-4 | 2-Bromo-4-methyl-5-nitrophenol

AG003GOI

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CAS Number	103448-24-4
Catalog Number	AG003GOI(AGN-PC-00OBVD)
Chemical Name	2-Bromo-4-methyl-5-nitrophenol
IUPAC Name	2-bromo-4-methyl-5-nitrophenol
InChI	InChI=1S/C7H6BrNO3/c1-4-2-5(8)7(10)3-6(4)9(11)12/h2-3,10H,1H3
InChI Key	UNDCYNWWVCTFES-UHFFFAOYSA-N
MDL Number	MFCD27935372
Molecular Formula	C7H6BrNO3
Molecular Weight	232.0314
SMILES	OC1=CC([N+]([O-])=O)=C(C)C=C1Br
Synonyms	2-Bromo-4-methyl-5-nitrophenol, 103448-24-4, Phenol, 2-bromo-4-methyl-5-nitro-, ACMC-20m6at, SCHEMBL9867327, CTK0D8546, DTXSID90551859, KS-000009DE, MFCD27935372, ZINC34175002, AKOS027256669, CS-11634, DA-48238, SY027057, FT-0710066, MFCD27935372 (95%),

Complexity	182
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	230.953g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	232.033g/mol
Monoisotopic Mass	230.953g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	66A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

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