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1167056-36-1 | 1H-Pyrrolo[3,2-c]pyridine-4-carboxylic acid, ethyl ester
CAS No: 1167056-36-1 Catalog No: AG000D36 MDL No:MFCD11845588
Product Description
Catalog Number:
AG000D36
Chemical Name:
1H-Pyrrolo[3,2-c]pyridine-4-carboxylic acid, ethyl ester
CAS Number:
1167056-36-1
Molecular Formula:
C10H10N2O2
Molecular Weight:
190.1986
MDL Number:
MFCD11845588
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
SMILES:
CCOC(=O)c1nccc2c1cc[nH]2
Properties
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
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