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Home > Aldehydes > 251102-31-5
251102-31-5 | Pyrrolo[1,2-c]pyrimidine-7-carboxaldehyde
CAS No: 251102-31-5 Catalog No: AG002QIA MDL No:
Product Description
Catalog Number:
AG002QIA
Chemical Name:
Pyrrolo[1,2-c]pyrimidine-7-carboxaldehyde
CAS Number:
251102-31-5
Molecular Formula:
C8H6N2O
Molecular Weight:
146.1460
IUPAC Name:
pyrrolo[1,2-c]pyrimidine-7-carbaldehyde
InChI:
InChI=1S/C8H6N2O/c11-5-8-2-1-7-3-4-9-6-10(7)8/h1-6H
InChI Key:
YNPIBFCBPPCFBZ-UHFFFAOYSA-N
SMILES:
O=Cc1ccc2n1cncc2
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.048g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
146.149g/mol
Monoisotopic Mass:
146.048g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
34.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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