AG006UCB

1521-41-1 | 3,4-Dimethoxybenzamide

AG006UCB

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CAS Number	1521-41-1
Catalog Number	AG006UCB(AGN-PC-0JLB4W)
Chemical Name	3,4-Dimethoxybenzamide
EC Number	216-190-5
IUPAC Name	3,4-dimethoxybenzamide
InChI	InChI=1S/C9H11NO3/c1-12-7-4-3-6(9(10)11)5-8(7)13-2/h3-5H,1-2H3,(H2,10,11)
InChI Key	XNDZRGTVUVVHQT-UHFFFAOYSA-N
MDL Number	MFCD00017128
Molecular Formula	C9H11NO3
Molecular Weight	181.1885
NSC Number	370837
SMILES	O(C)c1c(OC)ccc(c1)C(=O)N
UNII	SEW9F1FKI8
Synonyms	3,4-Dimethoxybenzamide, 1521-41-1, Benzamide, 3,4-dimethoxy-, Veratramide, Veratrimidic acid, 3,4-Dimethoxy-benzamide, EINECS 216-190-5, UNII-SEW9F1FKI8, SEW9F1FKI8, NSC 370837, BRN 2646714, NSC370837, AC1L2KBY, Oprea1_176663, Oprea1_802187, 3-10-00-01427 (Beilstein Handbook Reference), SCHEMBL335681, CHEMBL505584, DTXSID1074549, CTK8B7513, XNDZRGTVUVVHQT-UHFFFAOYSA-N, ZINC298681, KS-000001WY, 7629AA, ANW-57533, MFCD00017128, AKOS000593686, MCULE-5915938165, NSC-370837, RP24235, 4CN-1031, AJ-19037, BAS 00646010, LS-26547, ZB010278, TC-146278, CS-0017631, FT-0656647, ST24041161, A809265, J-511211, S01-0541, Z33546772, C9H11NO3, C9-H11-N-O3, CID73705,

Complexity	184
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	181.074g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	181.191g/mol
Monoisotopic Mass	181.074g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	61.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1

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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