AG0007FK

10242-03-2 | 1H-Indole-3-carboxylic acid, 6-nitro-

AG0007FK

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CAS Number	10242-03-2
Catalog Number	AG0007FK(AGN-PC-0JNT93)
Chemical Name	1H-Indole-3-carboxylic acid, 6-nitro-
IUPAC Name	6-nitro-1H-indole-3-carboxylic acid
InChI	InChI=1S/C9H6N2O4/c12-9(13)7-4-10-8-3-5(11(14)15)1-2-6(7)8/h1-4,10H,(H,12,13)
InChI Key	MWFVAHOPRCFNCA-UHFFFAOYSA-N
MDL Number	MFCD07779489
Molecular Formula	C9H6N2O4
Molecular Weight	206.1549
NSC Number	82382
SMILES	O=C(C1=CNC2=C1C=CC([N+]([O-])=O)=C2)O
Synonyms	6-nitro-1h-indole-3-carboxylic acid, 10242-03-2, 6-NITROINDOLE-3-CARBOXYLIC ACID, 24964-26-9, NSC82382, AC1L5TVC, AC1Q1ZRB, AC1Q740V, SCHEMBL2843383, CTK0H8898, DTXSID50292418, MWFVAHOPRCFNCA-UHFFFAOYSA-N, BCP21942, ZINC1631248, 0612AA, ANW-52966, MFCD07779489, NSC-82382, AKOS000119262, 1H-Indole-3-carboxylicacid, 6-nitro-, MCULE-2935111680, 1H-Indole-3-carboxylic acid, 6-nitro-, AJ-28453, SY058812, DB-058815, TC-141711, FT-0701490, ST24029829, EN300-23393, MFCD07779489 (95%), A-7162, N-3301, C9H6N2O4, 6-Nitro-1H-indole-3-carboxylicacid, AR-1H2380, CID256099, 110115-55-4,

Complexity	288
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	206.033g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	206.157g/mol
Monoisotopic Mass	206.033g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	98.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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