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919482-06-7 | 2-Pyrrolidinecarboxaldehyde, 1-ethyl-, (2S)-
CAS No: 919482-06-7 Catalog No: AG006IKO MDL No:
Product Description
Catalog Number:
AG006IKO
Chemical Name:
2-Pyrrolidinecarboxaldehyde, 1-ethyl-, (2S)-
CAS Number:
919482-06-7
Molecular Formula:
C7H13NO
Molecular Weight:
127.1842
IUPAC Name:
(2S)-1-ethylpyrrolidine-2-carbaldehyde
InChI:
InChI=1S/C7H13NO/c1-2-8-5-3-4-7(8)6-9/h6-7H,2-5H2,1H3/t7-/m0/s1
InChI Key:
JZTDQNCGEQOQLX-ZETCQYMHSA-N
SMILES:
O=C[C@@H]1CCCN1CC
Properties
Complexity:
103
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
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:
2
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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