AG003GEH

26961-27-3 | 2-Amino-4,5-dimethoxybenzonitrile

AG003GEH

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CAS Number	26961-27-3
Catalog Number	AG003GEH(AGN-PC-0JVO5J)
Chemical Name	2-Amino-4,5-dimethoxybenzonitrile
IUPAC Name	2-amino-4,5-dimethoxybenzonitrile
InChI	InChI=1S/C9H10N2O2/c1-12-8-3-6(5-10)7(11)4-9(8)13-2/h3-4H,11H2,1-2H3
InChI Key	BJAYMNUBIULRMF-UHFFFAOYSA-N
MDL Number	MFCD00058682
Molecular Formula	C9H10N2O2
Molecular Weight	178.1879
SMILES	N#CC1=CC(OC)=C(OC)C=C1N
Synonyms	2-Amino-4,5-dimethoxybenzonitrile, 26961-27-3, 6-Aminoveratronitrile, 4-Amino-5-cyanoveratrole, 2-Cyano-4,5-Dimethoxyaniline, Benzonitrile, 2-amino-4,5-dimethoxy-, 6-Amino-3,4-dimethoxybenzonitrile, 2-amino-4,5-dimethoxy-benzonitrile, MFCD00058682, 26961-27-3 2-amino-4,5-dimethoxybenzonitrile, 2-amino-4,5-dimethoxybenzenecarbonitrile, ZERO/005120, PubChem4632, ACMC-209wvj, AC1LEH1X, ChemDiv3_011209, AC1Q48JI, AC1Q4R7F, SCHEMBL82833, KSC496C5L, CTK3J6155, KS-00000ZZH, TIMTEC-BB SBB002931, DTXSID80352892, ATTERCOP-CHM AT134117, BJAYMNUBIULRMF-UHFFFAOYSA-N, 4,5-dimethoxy-2-aminobenzonitrile, HMS1504N11, WT123, ZINC154785, ACT08549, 2-amino-4,5-dimethoxy benzonitrile, ANW-46877, CA-254, LABOTEST-BB LT00080710, LABOTEST-BB LT03329281, SBB002931, STK776272, AKOS001848887, AC-4017, AM61875, AS01600, CM12915, CS-W017332, MB00492, MCULE-2259269235, PS-6197, RTR-012152, IDI1_028767, TRA-0184216, AJ-13376, AN-12426, CJ-01370, ZB005878, AB0010309, CK-04-001, DB-047069, ST2404120, ST4105021, TR-012152, 4CH-002537, FT-0617193, TL80090503, Q-9261, AQ-358/42003062, I01-4757, J-016632, BRD-K14422341-001-01-1, InChI=1/C9H10N2O2/c1-12-8-3-6(5-10)7(11)4-9(8)13-2/h3-4H,11H2,1-2H, C9H10N2O2, 2-Amino-4,5-dimethoxybenzonitril, AR-1D8306, CID735967, 27096-57-7,

Complexity	211
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	178.074g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	178.191g/mol
Monoisotopic Mass	178.074g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	68.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H302-H312-H319-H332
Packing Group	Ⅲ
Precautionary statements	P261-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313-P337+P313
UN Code	UN 3439

Certificate of Analysis

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