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13908-75-3 | Urea, N-(2-chloropropyl)-N'-cyclohexyl-
CAS No: 13908-75-3 Catalog No: AG001A6P MDL No:
Product Description
Catalog Number:
AG001A6P
Chemical Name:
Urea, N-(2-chloropropyl)-N'-cyclohexyl-
CAS Number:
13908-75-3
Molecular Formula:
C10H19ClN2O
Molecular Weight:
218.7237
IUPAC Name:
1-(2-chloropropyl)-3-cyclohexylurea
InChI:
InChI=1S/C10H19ClN2O/c1-8(11)7-12-10(14)13-9-5-3-2-4-6-9/h8-9H,2-7H2,1H3,(H2,12,13,14)
InChI Key:
LMDNWEYBVLKLNF-UHFFFAOYSA-N
SMILES:
CC(CNC(=O)NC1CCCCC1)Cl
NSC Number:
95967
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.119g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
218.725g/mol
Monoisotopic Mass:
218.119g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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