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13908-85-5 | Urea, N,N'-bis(2-bromoethyl)-
CAS No: 13908-85-5 Catalog No: AG001A7X MDL No:
Product Description
Catalog Number:
AG001A7X
Chemical Name:
Urea, N,N'-bis(2-bromoethyl)-
CAS Number:
13908-85-5
Molecular Formula:
C5H10Br2N2O
Molecular Weight:
273.9537
IUPAC Name:
1,3-bis(2-bromoethyl)urea
InChI:
InChI=1S/C5H10Br2N2O/c6-1-3-8-5(10)9-4-2-7/h1-4H2,(H2,8,9,10)
InChI Key:
AUNYHZLTTKGVFN-UHFFFAOYSA-N
SMILES:
BrCCNC(=O)NCCBr
NSC Number:
82192
Properties
Complexity:
89.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.914g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
273.956g/mol
Monoisotopic Mass:
271.916g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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