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102434-23-1 | Urea, N-(2-bromoethyl)-N'-(2-ethoxy-1-naphthalenyl)-
CAS No: 102434-23-1 Catalog No: AG0007H6 MDL No:
Product Description
Catalog Number:
AG0007H6
Chemical Name:
Urea, N-(2-bromoethyl)-N'-(2-ethoxy-1-naphthalenyl)-
CAS Number:
102434-23-1
Molecular Formula:
C15H17BrN2O2
Molecular Weight:
337.2117
IUPAC Name:
1-(2-bromoethyl)-3-(2-ethoxynaphthalen-1-yl)urea
InChI:
InChI=1S/C15H17BrN2O2/c1-2-20-13-8-7-11-5-3-4-6-12(11)14(13)18-15(19)17-10-9-16/h3-8H,2,9-10H2,1H3,(H2,17,18,19)
InChI Key:
UHRBGPMASDLVQW-UHFFFAOYSA-N
SMILES:
BrCCNC(=O)Nc1c(OCC)ccc2c1cccc2
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.047g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
337.217g/mol
Monoisotopic Mass:
336.047g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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