AG00GRGR

912347-94-5 | 2-Methyl-3-amino-4-acetylanisole

AG00GRGR

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CAS Number	912347-94-5
Catalog Number	AG00GRGR(AGN-PC-04Z0Y0)
Chemical Name	2-Methyl-3-amino-4-acetylanisole
IUPAC Name	1-(2-amino-4-methoxy-3-methylphenyl)ethanone
InChI	InChI=1S/C10H13NO2/c1-6-9(13-3)5-4-8(7(2)12)10(6)11/h4-5H,11H2,1-3H3
InChI Key	VXBGCEDOGYNWHE-UHFFFAOYSA-N
MDL Number	MFCD11042290
Molecular Formula	C10H13NO2
Molecular Weight	179.2157
SMILES	NC1=C(C=CC(=C1C)OC)C(C)=O
Synonyms	912347-94-5, 1-(2-amino-4-methoxy-3-methylphenyl)ethanone, 2-METHYL-3-AMINO-4-ACETYLANISOLE, 1-(2-amino-4-methoxy-3-methylphenyl)ethan-1-one, Ethanone, 1-(2-amino-4-methoxy-3-methylphenyl)-, 1-(2-Amino-3-methyl-4-methoxyphenyl)ethanone, 1-(2-amino-4-methoxy-3-methylphenyl)-Ethanone, 6-acetyl-3-methoxy-2-methyl aniline, 2-Amino-4-methoxy-3-methylacetophenone, AK-26434, (2-Amino-3-methyl-4-methoxyphenyl)acetone, 2'-Amino-4'-methoxy-3'-methylacetophenone, 1-(2-amino-4-methoxy-3-methyl-phenyl)ethanone, 1-(2-amino-4-methoxy-3-methyl-phenyl)-ethanone, Ethanone,1-(2-amino-4-methoxy-3-methylphenyl)-, Q-101063, zlchem 579, PubChem19710, SCHEMBL312873, ETH027, CTK5G9092, DTXSID40648622, ZLD0023, VXBGCEDOGYNWHE-UHFFFAOYSA-N, 6-acetyl-3-metoxy-2-methylaniline, ACT06000, BCP21928, CS-B0016, KS-00000KT3, ZX-RL004073, 2-acetyl-5-methoxy-6-methylaniline, 6-acetyl-3-methoxy-2-methylaniline, ANW-52323, FCH886818, MFCD11042290, ZINC21303871, 2-methyl-3-methoxy-6-acetyl-aniline, AKOS006306549, AS05089, CM-1182, CM11129, RP24058, VZ20830, 1-(2-amino-4-methoxy-3-methylphenyl)-, 2-amino-4-methoxy-3-methylbenzoic acid, AC-22904, AJ-78477, AN-26398, BC677904, BR-26434, CJ-16933, DS-10893, EN000387, OR301383, SC-26352, SY020361, AB0027522, AX8035400, DB-023146, ST2414936, TC-062621, 4CH-013693, AM20080917, FT-0649257, TL80073483, W9363, MFCD11042290 (95%), S-3960, (2-amino-4-methoxy-3-methylphenyl)(methyl)ketone, 907A342, 1-[2-amino-3-methyl-4-(methyloxy)phenyl]ethanone, S05-0125, 2-methyl-3-amino-4-acetylanisole;1-(2-amino-4-methoxy-3-methylphenyl)ethanone, 2 inverted exclamation mark -Amino-4 inverted exclamation mark -methoxy-3 inverted exclamation mark -methylacetophenone, Benzyltriethylammonium borohydride, C10H13NO2, ACN-027224, A10847,

Complexity	193
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	179.095g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	179.219g/mol
Monoisotopic Mass	179.095g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	52.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number