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100452-86-6 | 1-Propanone, 1-(1-cyclopenten-1-yl)-3-(diethylamino)-
CAS No: 100452-86-6 Catalog No: AG00020P MDL No:
Product Description
Catalog Number:
AG00020P
Chemical Name:
1-Propanone, 1-(1-cyclopenten-1-yl)-3-(diethylamino)-
CAS Number:
100452-86-6
Molecular Formula:
C12H21NO
Molecular Weight:
195.3012
IUPAC Name:
1-(cyclopenten-1-yl)-3-(diethylamino)propan-1-one
InChI:
InChI=1S/C12H21NO/c1-3-13(4-2)10-9-12(14)11-7-5-6-8-11/h7H,3-6,8-10H2,1-2H3
InChI Key:
HMIQUVDZKXXEAH-UHFFFAOYSA-N
SMILES:
CCN(CCC(=O)C1=CCCC1)CC
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.162g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.306g/mol
Monoisotopic Mass:
195.162g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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