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1261885-66-8 | 1H-Pyrrolo[3,2-b]pyridine-6-carboxylic acid, ethyl ester
CAS No: 1261885-66-8 Catalog No: AG000S34 MDL No:MFCD18416564
Product Description
Catalog Number:
AG000S34
Chemical Name:
1H-Pyrrolo[3,2-b]pyridine-6-carboxylic acid, ethyl ester
CAS Number:
1261885-66-8
Molecular Formula:
C10H10N2O2
Molecular Weight:
190.1986
MDL Number:
MFCD18416564
IUPAC Name:
ethyl 1H-pyrrolo[3,2-b]pyridine-6-carboxylate
InChI:
InChI=1S/C10H10N2O2/c1-2-14-10(13)7-5-9-8(12-6-7)3-4-11-9/h3-6,11H,2H2,1H3
InChI Key:
NAJRZBFAOZOKDX-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cnc2c(c1)[nH]cc2
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:
1.3
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