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16813-43-7 | Ethanediamide, N1,N2-bis(2-chloroethyl)-
CAS No: 16813-43-7 Catalog No: AG001XUP MDL No:MFCD00151809
Product Description
Catalog Number:
AG001XUP
Chemical Name:
Ethanediamide, N1,N2-bis(2-chloroethyl)-
CAS Number:
16813-43-7
Molecular Formula:
C6H10Cl2N2O2
Molecular Weight:
213.0618
MDL Number:
MFCD00151809
IUPAC Name:
N,N'-bis(2-chloroethyl)oxamide
InChI:
InChI=1S/C6H10Cl2N2O2/c7-1-3-9-5(11)6(12)10-4-2-8/h1-4H2,(H,9,11)(H,10,12)
InChI Key:
MUAULJMMFLVLHM-UHFFFAOYSA-N
SMILES:
ClCCNC(=O)C(=O)NCCCl
NSC Number:
83698
Properties
Complexity:
146
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.012g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
213.058g/mol
Monoisotopic Mass:
212.012g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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