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13788-32-4 | 1H-Pyrrole-2-carboxaldehyde, 1-(2-furanylmethyl)-
CAS No: 13788-32-4 Catalog No: AG00140M MDL No:MFCD09674985
Product Description
Catalog Number:
AG00140M
Chemical Name:
1H-Pyrrole-2-carboxaldehyde, 1-(2-furanylmethyl)-
CAS Number:
13788-32-4
Molecular Formula:
C10H9NO2
Molecular Weight:
175.1840
MDL Number:
MFCD09674985
IUPAC Name:
1-(furan-2-ylmethyl)pyrrole-2-carbaldehyde
InChI:
InChI=1S/C10H9NO2/c12-8-9-3-1-5-11(9)7-10-4-2-6-13-10/h1-6,8H,7H2
InChI Key:
PYBJPTHZYBWJON-UHFFFAOYSA-N
SMILES:
O=Cc1cccn1Cc1ccco1
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.063g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
175.187g/mol
Monoisotopic Mass:
175.063g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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