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Home > Aldehydes > 1082482-18-5
1082482-18-5 | 1-BUTANOYLPYRROLIDINE-2-CARBALDEHYDE
CAS No: 1082482-18-5 Catalog No: AG01DQEY MDL No:MFCD11583081
Product Description
Catalog Number:
AG01DQEY
Chemical Name:
1-BUTANOYLPYRROLIDINE-2-CARBALDEHYDE
CAS Number:
1082482-18-5
Molecular Formula:
C9H15NO2
Molecular Weight:
169.2209
MDL Number:
MFCD11583081
IUPAC Name:
1-butanoylpyrrolidine-2-carbaldehyde
InChI:
InChI=1S/C9H15NO2/c1-2-4-9(12)10-6-3-5-8(10)7-11/h7-8H,2-6H2,1H3
InChI Key:
WGIGNSZPTXFXEI-UHFFFAOYSA-N
SMILES:
CCCC(=O)N1CCCC1C=O
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.11g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.224g/mol
Monoisotopic Mass:
169.11g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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