AG000D36

1167056-36-1 | 1H-Pyrrolo[3,2-c]pyridine-4-carboxylic acid, ethyl ester

AG000D36

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CAS Number	1167056-36-1
Catalog Number	AG000D36(AGN-PC-07ZRTA)
Chemical Name	1H-Pyrrolo[3,2-c]pyridine-4-carboxylic acid, ethyl ester
IUPAC Name	ethyl 1H-pyrrolo[3,2-c]pyridine-4-carboxylate
InChI	InChI=1S/C10H10N2O2/c1-2-14-10(13)9-7-3-5-11-8(7)4-6-12-9/h3-6,11H,2H2,1H3
InChI Key	IWRBCFHIOKZTJY-UHFFFAOYSA-N
MDL Number	MFCD11845588
Molecular Formula	C10H10N2O2
Molecular Weight	190.1986
SMILES	O=C(C1=NC=CC2=C1C=CN2)OCC
Synonyms	ethyl 1H-pyrrolo[3,2-c]pyridine-4-carboxylate, 1167056-36-1, AK119747, 5-Azaindole-4-carboxylic acid ethyl ester, 1H-pyrrolo[3,2-c]pyridine-4-carboxylic acid ethyl ester, Ethyl 5-azaindole-4-carboxylate, DTXSID20676827, KS-00000R2B, 2735AA, CE-825, MFCD11845588, ZINC44184775, AKOS016010953, DS-5738, FCH1156923, QC-2890, ACM1167056361, AB0095384, AJ-109482, AX8245163, DB-060911, 4CH-003427, FT-0654377, ST24046749, W-1502, A803663, S14-1669, 1H-Pyrrolo[3,2-c]pyridine-4-carboxylic acid, ethyl ester, C10H10N2O2, Ethyl1H-pyrrolo[3,2-c]pyridine-4-carboxylate,

Complexity	220
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	1
Isotope Atom Count	0
Molecular Weight	190.202g/mol
Monoisotopic Mass	190.074g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	55A^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-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

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