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828267-00-1 | Piperidine, 1-(3-iodobutyl)-4-methyl-
CAS No: 828267-00-1 Catalog No: AG008IAR MDL No:
Product Description
Catalog Number:
AG008IAR
Chemical Name:
Piperidine, 1-(3-iodobutyl)-4-methyl-
CAS Number:
828267-00-1
Molecular Formula:
C10H20IN
Molecular Weight:
281.1770
IUPAC Name:
1-(3-iodobutyl)-4-methylpiperidine
InChI:
InChI=1S/C10H20IN/c1-9-3-6-12(7-4-9)8-5-10(2)11/h9-10H,3-8H2,1-2H3
InChI Key:
HGCFOEXNAVCPGI-UHFFFAOYSA-N
SMILES:
CC(CCN1CCC(CC1)C)I
Properties
Complexity:
119
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.064g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.181g/mol
Monoisotopic Mass:
281.064g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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