AG000MXK

1249763-34-5 | 1H-Indole-3-carboxylic acid, 6-amino-, methyl ester

AG000MXK

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CAS Number	1249763-34-5
Catalog Number	AG000MXK(AGN-PC-0DXM6J)
Chemical Name	1H-Indole-3-carboxylic acid, 6-amino-, methyl ester
IUPAC Name	methyl 6-amino-1H-indole-3-carboxylate
InChI	InChI=1S/C10H10N2O2/c1-14-10(13)8-5-12-9-4-6(11)2-3-7(8)9/h2-5,12H,11H2,1H3
InChI Key	LYNKTDFIPVBZHP-UHFFFAOYSA-N
MDL Number	MFCD14622148
Molecular Formula	C10H10N2O2
Molecular Weight	190.1986
SMILES	O=C(C1=CNC2=C1C=CC(N)=C2)OC
Synonyms	methyl 6-amino-1H-indole-3-carboxylate, 1249763-34-5, SCHEMBL5631381, KS-000004JT, MFCD14622148, ZINC41046568, AKOS010564565, SB11930, AS-34032, SC-43677, CS-0048953, 1H-Indole-3-carboxylic acid, 6-amino-, methyl ester, Z1179717755,

Complexity	232
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	190.074g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	190.202g/mol
Monoisotopic Mass	190.074g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	68.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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