AG001QHD

1591-37-3 | Benzonitrile, 2-amino-6-methoxy-

AG001QHD

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CAS Number	1591-37-3
Catalog Number	AG001QHD(AGN-PC-0NK04X)
Chemical Name	Benzonitrile, 2-amino-6-methoxy-
IUPAC Name	2-amino-6-methoxybenzonitrile
InChI	InChI=1S/C8H8N2O/c1-11-8-4-2-3-7(10)6(8)5-9/h2-4H,10H2,1H3
InChI Key	LBVLXRZXEOPYDW-UHFFFAOYSA-N
MDL Number	MFCD09745275
Molecular Formula	C8H8N2O
Molecular Weight	148.1619
SMILES	COC1=CC=CC(N)=C1C#N
Synonyms	2-amino-6-methoxybenzonitrile, 1591-37-3, 2-Amino-6-methoxy-benzonitrile, Benzonitrile, 2-amino-6-methoxy-, AK-33502, W-201437, 6-Methoxyanthranilonitrile, 2-Cyano-3-methoxy-aniline, 6-methoxy-2-aminobenzonitrile, SCHEMBL620373, CTK0E6969, KS-00000HNO, DTXSID80507800, LBVLXRZXEOPYDW-UHFFFAOYSA-N, ANW-56738, FCH869539, MFCD09745275, TD1369, ZINC21304506, AKOS006332434, CS-W006615, DS-2258, MP-1592, AJ-78540, CJ-16949, OR321007, SC-13143, SY035418, AB0059729, AX8159814, TC-145483, 4CH-008471, FT-0696700, FT-0696701, ST24027751, TL80074071, Z4229, MFCD09745275 (95%), C8H8N2O, ACN-038543,

Complexity	172
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	148.064g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	148.165g/mol
Monoisotopic Mass	148.064g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	59A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number