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102434-00-4 | Urea, N-(2-chloroethyl)-N'-[2-(2-propen-1-yl)phenyl]-
CAS No: 102434-00-4 Catalog No: AG0007HF MDL No:
Product Description
Catalog Number:
AG0007HF
Chemical Name:
Urea, N-(2-chloroethyl)-N'-[2-(2-propen-1-yl)phenyl]-
CAS Number:
102434-00-4
Molecular Formula:
C12H15ClN2O
Molecular Weight:
238.7133
IUPAC Name:
1-(2-chloroethyl)-3-(2-prop-2-enylphenyl)urea
InChI:
InChI=1S/C12H15ClN2O/c1-2-5-10-6-3-4-7-11(10)15-12(16)14-9-8-13/h2-4,6-7H,1,5,8-9H2,(H2,14,15,16)
InChI Key:
GVPRVQMWAGIIMZ-UHFFFAOYSA-N
SMILES:
ClCCNC(=O)Nc1ccccc1CC=C
NSC Number:
160189
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.087g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
238.715g/mol
Monoisotopic Mass:
238.087g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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