AG003JK1

78238-14-9 | 3-Hydroxy-5-nitrobenzoic acid

AG003JK1

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CAS Number	78238-14-9
Catalog Number	AG003JK1(AGN-PC-0JWJPK)
Chemical Name	3-Hydroxy-5-nitrobenzoic acid
IUPAC Name	3-hydroxy-5-nitrobenzoic acid
InChI	InChI=1S/C7H5NO5/c9-6-2-4(7(10)11)1-5(3-6)8(12)13/h1-3,9H,(H,10,11)
InChI Key	ZVLLYIMPDTXFNC-UHFFFAOYSA-N
MDL Number	MFCD01098212
Molecular Formula	C7H5NO5
Molecular Weight	183.1183
SMILES	O=C(O)C1=CC([N+]([O-])=O)=CC(O)=C1
Synonyms	3-hydroxy-5-nitrobenzoic acid, 78238-14-9, 3-hydroxy-5-nitro-benzoic acid, 5-hydroxy-3-nitrobenzoic acid, AC1LGFEX, PubChem12824, ACMC-20a6op, AC1Q5ALI, Oprea1_840893, AO-801/41077444, SCHEMBL417424, 3-nitro-5-oxidanyl-benzoic acid, CTK5E5553, DTXSID50356201, Benzoic acid,3-hydroxy-5-nitro-, ZVLLYIMPDTXFNC-UHFFFAOYSA-N, ZINC336746, Benzoic acid, 3-hydroxy-5-nitro-, ANW-59591, MFCD01098212, SBB089991, 3-Hydroxy-5-nitrobenzoic acid, 97%, AKOS000299824, AB08254, MCULE-5861198770, AJ-19805, AK-47123, AN-36694, SC-49034, AB0030604, TC-148336, FT-0084422, FT-0660269, ST24042209, ST50979875, X2812, W-3033, 238H149, A839372, I01-9201, J-512640, Z1815156889, C7H5NO5, 3-HYDROXY-5-NITROBENZOICACID, AR-1F3660, CID820393, ACN-051288, C2469, 79467-23-5,

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

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

Lot Number