AG006QKP

90417-29-1 | 6-Amino-1H-indole-3-carboxylic acid

AG006QKP

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CAS Number	90417-29-1
Catalog Number	AG006QKP(AGN-PC-0JNT92)
Chemical Name	6-Amino-1H-indole-3-carboxylic acid
IUPAC Name	6-amino-1H-indole-3-carboxylic acid
InChI	InChI=1S/C9H8N2O2/c10-5-1-2-6-7(9(12)13)4-11-8(6)3-5/h1-4,11H,10H2,(H,12,13)
InChI Key	LOPPIPLZGUYXJD-UHFFFAOYSA-N
MDL Number	MFCD13178386
Molecular Formula	C9H8N2O2
Molecular Weight	176.1720
NSC Number	82380
SMILES	O=C(C1=CNC2=C1C=CC(N)=C2)O
Synonyms	6-amino-1h-indole-3-carboxylic acid, 90417-29-1, 6-Aminoindole-3-carboxylic acid, NSC82380, 1H-Indole-3-carboxylic acid, 6-amino-, AC1L5TV9, AC1Q52CO, AC1Q5UN2, CTK5G7841, DTXSID90292417, ZINC1631245, CL3471, MFCD13178386, NSC-82380, 6-amino-1H-indole-3-carboxylic?acid, AKOS010563188, MCULE-9310921101, NE28150, AC-23273, AS-45962, EN300-71658, Z1270387274, AR-1H0819, CID256097, 91365-97-8,

Complexity	220
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	176.059g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	176.175g/mol
Monoisotopic Mass	176.059g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	79.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H317
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number