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114998-55-9 | Piperidine, 4-(2-chloroethyl)-
CAS No: 114998-55-9 Catalog No: AG000FIX MDL No:
Product Description
Catalog Number:
AG000FIX
Chemical Name:
Piperidine, 4-(2-chloroethyl)-
CAS Number:
114998-55-9
Molecular Formula:
C7H14ClN
Molecular Weight:
147.6458
IUPAC Name:
4-(2-chloroethyl)piperidine
InChI:
InChI=1S/C7H14ClN/c8-4-1-7-2-5-9-6-3-7/h7,9H,1-6H2
InChI Key:
OKFLXXZLKOMXMO-UHFFFAOYSA-N
SMILES:
ClCCC1CCNCC1
Properties
Complexity:
69.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.081g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
147.646g/mol
Monoisotopic Mass:
147.081g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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