AG002GRQ

1882-69-5 | Benzoic acid, 5-methoxy-2-nitro-

AG002GRQ

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CAS Number	1882-69-5
Catalog Number	AG002GRQ(AGN-PC-0JMCT6)
Chemical Name	Benzoic acid, 5-methoxy-2-nitro-
EC Number	606-135-7
IUPAC Name	5-methoxy-2-nitrobenzoic acid
InChI	InChI=1S/C8H7NO5/c1-14-5-2-3-7(9(12)13)6(4-5)8(10)11/h2-4H,1H3,(H,10,11)
InChI Key	URADKXVAIGMTEG-UHFFFAOYSA-N
MDL Number	MFCD00151836
Molecular Formula	C8H7NO5
Molecular Weight	197.1449
NSC Number	364656
SMILES	O=C(O)C1=CC(OC)=CC=C1[N+]([O-])=O
Synonyms	5-Methoxy-2-nitrobenzoic acid, 1882-69-5, 6-Nitro-m-anisic Acid, 2-Nitro-5-methoxybenzoic acid, Benzoic acid, 5-methoxy-2-nitro-, MFCD00151836, 5-methoxy-2-nitro-benzoic acid, URADKXVAIGMTEG-UHFFFAOYSA-N, 5-Methoxy-2-nitrobenzoic acid, 97%, NSC364656, PubChem4229, ACMC-1BRD6, 2-Nitro-5-methoxybenzoate, AC1L7PH8, 2-Nitro-5-methoxybenzoicacid, 5-Methoxy-2-nitrobenzoicAcid, KSC495E6D, SCHEMBL269614, AC1Q486S, Jsp003862, 2-nitro-5-methoxy benzoic acid, CTK3J5261, KS-00000CBE, TIMTEC-BB SBB028524, DTXSID90320805, WT046, ZINC163370, 5-(methyloxy)-2-nitrobenzoic acid, ACT12273, BCP28909, STR05879, AN-375, ANW-23388, SBB028524, AKOS000147444, AC-1099, AS00757, CM12838, CS-W002435, MCULE-8399808603, NSC-364656, RP25517, RTR-008717, TRA0057264, AJ-16025, AK-27716, BC220616, BR-27716, SC-02025, SY002263, AB0011387, DB-044670, ST2412066, TL8001528, TR-008717, 1882-69-5 5-methoxy-2-nitrobenzoic acid, AM20060092, FT-0085061, FT-0620559, M2245, M6282, ST50405872, EN300-51143, A20392, M-2293, MFCD00151836 (97+%), 882M695, 2-nitro-5-methoxybenzoic acid;6-Nitro-m-anisicacid, I01-0284, J-012127, J-517682, Z90146674, F0001-0675, InChI=1/C8H7NO5/c1-14-5-2-3-7(9(12)13)6(4-5)8(10)11/h2-4H,1H3,(H,10,11, C8H7NO5, Acide 3-methoxy-6-nitrobenzoique, Acide methoxy-3-nitro-6-benzoique, CID339209, 5-Methoxy-2-nitrobenzoic acid, 97% - 25G 25g, 106-49-0,

Complexity	236
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	197.032g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	197.146g/mol
Monoisotopic Mass	197.032g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	92.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number