Home Aldehydes 3-Piperidinecarboxaldehyde, 1-methyl-

3-Piperidinecarboxaldehyde, 1-methyl-

CAS No.:
99658-56-7
Catalog Number:
AG00IKBN
Molecular Formula:
C7H13NO
Molecular Weight:
127.1842
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Product Description
Catalog Number:
AG00IKBN
Chemical Name:
3-Piperidinecarboxaldehyde, 1-methyl-
CAS Number:
99658-56-7
Molecular Formula:
C7H13NO
Molecular Weight:
127.1842
IUPAC Name:
1-methylpiperidine-3-carbaldehyde
InChI:
InChI=1S/C7H13NO/c1-8-4-2-3-7(5-8)6-9/h6-7H,2-5H2,1H3
InChI Key:
DYYBIPJEINPRQG-UHFFFAOYSA-N
SMILES:
O=CC1CCCN(C1)C
Properties
Complexity:
103  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.1g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
127.187g/mol
Monoisotopic Mass:
127.1g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties