Home Halogens 5-Bis(2-chloroethyl)aminouracil

5-Bis(2-chloroethyl)aminouracil

CAS No.:
66-75-1
Catalog Number:
AG00FB54
Molecular Formula:
C8H11Cl2N3O2
Molecular Weight:
252.0978
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Product Description
Catalog Number:
AG00FB54
Chemical Name:
5-Bis(2-chloroethyl)aminouracil
CAS Number:
66-75-1
Molecular Formula:
C8H11Cl2N3O2
Molecular Weight:
252.0978
MDL Number:
MFCD00233542
IUPAC Name:
5-[bis(2-chloroethyl)amino]-1H-pyrimidine-2,4-dione
InChI:
InChI=1S/C8H11Cl2N3O2/c9-1-3-13(4-2-10)6-5-11-8(15)12-7(6)14/h5H,1-4H2,(H2,11,12,14,15)
InChI Key:
IDPUKCWIGUEADI-UHFFFAOYSA-N
SMILES:
ClCCN(c1cnc(nc1O)O)CCCl
EC Number:
200-631-3
UNII:
W7KQ46GJ8U
NSC Number:
34462
UN Number:
2811
Properties
Complexity:
288  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.023g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
252.095g/mol
Monoisotopic Mass:
251.023g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Literature
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