AG003HSX

3740-52-1 | 2-(2-Nitrophenyl)acetic acid

AG003HSX

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CAS Number	3740-52-1
Catalog Number	AG003HSX(AGN-PC-0JLQML)
Chemical Name	2-(2-Nitrophenyl)acetic acid
EC Number	223-128-0
IUPAC Name	2-(2-nitrophenyl)acetic acid
InChI	InChI=1S/C8H7NO4/c10-8(11)5-6-3-1-2-4-7(6)9(12)13/h1-4H,5H2,(H,10,11)
InChI Key	WMUZDBZPDLHUMW-UHFFFAOYSA-N
MDL Number	MFCD00007190
Molecular Formula	C8H7NO4
Molecular Weight	181.1455
NSC Number	16624
SMILES	C1=CC=CC(=C1[N+](=O)[O-])CC(O)=O
UNII	05TN0SUY38
Synonyms	(2-nitrophenyl)acetic acid, 2-nitrophenylacetic acid, o-nitrophenylacetic acid, 2-Nitrophenylacetic acid, 3740-52-1, 2-(2-nitrophenyl)acetic acid, o-Nitrophenylacetic acid, (2-Nitrophenyl)acetic acid, Benzeneacetic acid, 2-nitro-, Acetic acid, (o-nitrophenyl)-, (ortho-Nitrophenyl)acetic acid, 2-(o-Nitrophenyl)acetic acid, 2-Nitrobenzeneacetic acid, UNII-05TN0SUY38, MFCD00007190, CCRIS 2336, EINECS 223-128-0, NSC 16624, BRN 1959243, (2-Nitro-phenyl)-acetic acid, AI3-31297, 05TN0SUY38, WMUZDBZPDLHUMW-UHFFFAOYSA-N, 2-Nitrophenylacetic acid, 99%, 2-Nitro phenylacetic Acid, PubChem9868, AC1L2SUA, o-nitrophenyl acetic acid, 2-nitrophenyl acetic acid, orthonitrophenylacetic acid, ACMC-1CR3A, 2-NITROPHENYLACETATE, Cambridge id 5102607, Benzeneaceticacid, 2-nitro-, Oprea1_132121, KSC222O5T, ARONIS24102, SCHEMBL124031, AC1Q74V5, Jsp006613, 2-Nitrophenylacetic acid, 98%, DTXSID0063157, CTK1C2759, ZINC156503, EBD21050, KS-000046JC, NSC16624, STR03477, ANW-28630, BBL011770, C2N825, NSC-16624, SBB028500, STK411127, AKOS000104760, AN-6258, CS-W019512, MCULE-3522722427, PS-4967, RP24226, RTR-036631, TRA0086551, VZ20065, KS-0000053C, AJ-13821, AK-34908, BR-34908, LS-12615, SC-03956, SY002275, AB1003009, DB-011082, ST2416051, TL8002750, TR-036631, AM20060243, BB 0219319, FT-0613208, N0353, ST45028997, MFCD00007190 (98%), A24278, M-6318, W-106540, F0051-0001, null, o-Nitrobenzeneacetic acid, (o-Nitrophenyl)ethansaure, C8H7NO4, C8-H7-N-O4, CID77337, ACN-040625, 4-09-00-01687 (Beilstein Handbook Reference), 2-Nitrophenylacetic acid, 99% - 100G 100g, C119971, 1099621-14-3,

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	1.6

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

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