AG00IDHX

85-38-1 | 2-Hydroxy-3-nitrobenzoic acid

AG00IDHX

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CAS Number	85-38-1
Catalog Number	AG00IDHX(AGN-PC-0WAJPP)
Chemical Name	2-Hydroxy-3-nitrobenzoic acid
IUPAC Name	2-hydroxy-3-nitrobenzoic acid
InChI	InChI=1S/C7H5NO5/c9-6-4(7(10)11)2-1-3-5(6)8(12)13/h1-3,9H,(H,10,11)
InChI Key	WWWFHFGUOIQNJC-UHFFFAOYSA-N
MDL Number	MFCD00024240
Molecular Formula	C7H5NO5
Molecular Weight	183.1183
NSC Number	182
SMILES	O=C(O)C1=CC=CC([N+]([O-])=O)=C1O
UNII	47661X4L2C
Synonyms	3-Nitrosalicylic acid, 2-Hydroxy-3-nitrobenzoic acid, 85-38-1, Benzoic acid, 2-hydroxy-3-nitro-, Salicylic acid, 3-nitro-, 2-hydroxy-3-nitro-benzoic acid, UNII-47661X4L2C, NSC 182, BRN 2213132, AI3-08930, WWWFHFGUOIQNJC-UHFFFAOYSA-N, 47661X4L2C, 3-Nitrosalicylic acid, 98%, 3-Nitro-salicylsaure, 3-nitrosalicyclic acid, AC1L1NCJ, AC1Q1GXA, Salicylic acid, 3-nitro, WLN: WNR BQ CVQ, ACMC-209q5q, SCHEMBL71887, 4-10-00-00228 (Beilstein Handbook Reference), 2-Hydroxy-3-nitrobenzoic aci, Benzoic acid, 2-hydroxynitro-, NSC182, CTK0I5888, DTXSID80234048, NSC-182, ACT02944, KS-000002CA, ZERO/005759, ZINC1555336, ANW-38172, MFCD00024240, SBB013649, STK688148, AKOS000282179, AS06826, MCULE-2317048794, RP03299, AJ-75781, AM808249, AN-42306, AS-46787, BR-36578, EN002837, SC-21683, DB-031391, LS-144385, ST2416951, ST4127234, TR-032849, 3-Nitrosalicylic acid, >=99.0% (HPLC), FT-0616266, Mesalamine Impurity (3-Nitrosalicylic Acid), N0251, A20356, S-4360, AE-562/40897208, I04-0141, J-509624, W-110781, Z1431004172, 26894-89-3, 3-Nitrosalicylicacid, Mesalazine Impurity R, P-NITROSALICYLIC ACID, C7H5NO5, CID6807, C7-H5-N-O5, AR-1E2377, ACN-037021, CS-T-37158, BAY 59-3074, 406205-74-1, 91632-02-9,

Complexity	223
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	183.017g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	183.119g/mol
Monoisotopic Mass	183.017g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	103A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

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