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164667-55-4 | 4H-Furo[3,2-b]pyrrole-5-carboxylic acid, 2-formyl-, methyl ester
CAS No: 164667-55-4 Catalog No: AG001V14 MDL No:MFCD08531092
Product Description
Catalog Number:
AG001V14
Chemical Name:
4H-Furo[3,2-b]pyrrole-5-carboxylic acid, 2-formyl-, methyl ester
CAS Number:
164667-55-4
Molecular Formula:
C9H7NO4
Molecular Weight:
193.1562
MDL Number:
MFCD08531092
IUPAC Name:
methyl 2-formyl-4H-furo[3,2-b]pyrrole-5-carboxylate
InChI:
InChI=1S/C9H7NO4/c1-13-9(12)7-3-8-6(10-7)2-5(4-11)14-8/h2-4,10H,1H3
InChI Key:
RDJJCRWCUARXEE-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc2c([nH]1)cc(o2)C=O
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.038g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.158g/mol
Monoisotopic Mass:
193.038g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
72.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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