AG003JTP

1877-73-2 | 3-Nitrophenylacetic Acid

AG003JTP

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CAS Number	1877-73-2
Catalog Number	AG003JTP(AGN-PC-0JKCJX)
Chemical Name	3-Nitrophenylacetic Acid
EC Number	217-512-7
IUPAC Name	2-(3-nitrophenyl)acetic acid
InChI	InChI=1S/C8H7NO4/c10-8(11)5-6-2-1-3-7(4-6)9(12)13/h1-4H,5H2,(H,10,11)
InChI Key	WUKHOVCMWXMOOA-UHFFFAOYSA-N
MDL Number	MFCD00007278
Molecular Formula	C8H7NO4
Molecular Weight	181.1455
NSC Number	93911
SMILES	[N+](=O)([O-])C=1C=C(C=CC1)CC(=O)O
Synonyms	3-Nitrophenylacetic acid, 1877-73-2, (3-nitrophenyl)acetic acid, 2-(3-NITROPHENYL)ACETIC ACID, Benzeneacetic acid, 3-nitro-, m-Nitrophenylacetic acid, 3-Nitrobenzeneacetic acid, (m-Nitrophenyl)acetic acid, ACETIC ACID, (m-NITROPHENYL)-, CCRIS 2337, EINECS 217-512-7, MFCD00007278, NSC 93911, [3-Nitrophenyl]acetic acid, BRN 2050088, 2-(3-nitrophenyl)aceticacid, 3-Nitrophenylacetic acid, 99%, WUKHOVCMWXMOOA-UHFFFAOYSA-N, MNP, zlchem 744, PubChem24117, 1ai5, 3-nitrobenzeneaceticacid, 3-nitro-benzeneaceticaci, ACMC-1CBVH, rarechem al bo 0446, 3-nitrophenylessigs|Aure, m-Nitrophenyl acetic acid, (m-nitrophenyl)-aceticaci, 3-nitrophenyl acetic acid, 3-nitro phenyl acetic acid, Acetic acid, m-nitrophenyl-, (3-nitrophenyl) acetic acid, KSC497E0L, SCHEMBL296300, (3-Nitro-phenyl)-acetic acid, AC1L26T3, AC1Q74Z0, CHEMBL139020, 2-(3-nitro-phenyl)acetic acid, SCHEMBL14134783, CTK3J7205, WUKHOVCMWXMOOA-UHFFFAOYSA-, DTXSID60172075, ZLD0201, 3-NITRO-BENZENEACETIC ACID, ZINC156946, Benzeneacetic acid,3-nitro-(9CI), ACT05862, NSC93911, 3-(CARBOXYMETHYL)NITROBENZENE, ANW-23353, CL8780, NSC-93911, SBB069085, STK450326, AKOS000112327, Benzeneacetic acid, 3-nitro- (9CI), AS06121, CM13730, CS-W001143, DB08193, GS-3303, MCULE-1620041803, PB15594, RP24231, RTR-008683, TRA0051883, VZ27172, AJ-13917, AK-45424, AN-50029, BC264750, BR-45424, LS-12614, R946, SC-28887, SY005215, AB0018414, AB1003400, DB-044648, ST2407985, TR-008683, AM20030231, FT-0604719, N0442, ST50406230, EN300-64075, M-2598, MFCD00007278 (97+%), 877N732, J-505819, S04-0054, InChI=1/C8H7NO4/c10-8(11)5-6-2-1-3-7(4-6)9(12)13/h1-4H,5H2,(H,10,11), null, (m-Nitrophenyl)ethansaure, C8H7NO4, C8-H7-N-O4, CID15876, 3-Nitrophenylacetic acid, 99% - 1G 1g, 4-09-00-01687 (Beilstein Handbook Reference), 110-20-3,

Complexity	211
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	181.038g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	181.147g/mol
Monoisotopic Mass	181.038g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	83.1A^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