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116477-30-6 | Formamide, N-[4,6-dichloro-2-(formylamino)-5-pyrimidinyl]-
CAS No: 116477-30-6 Catalog No: AG000CLI MDL No:MFCD04974512
Product Description
Catalog Number:
AG000CLI
Chemical Name:
Formamide, N-[4,6-dichloro-2-(formylamino)-5-pyrimidinyl]-
CAS Number:
116477-30-6
Molecular Formula:
C6H4Cl2N4O2
Molecular Weight:
235.0276
MDL Number:
MFCD04974512
IUPAC Name:
N-(4,6-dichloro-2-formamidopyrimidin-5-yl)formamide
InChI:
InChI=1S/C6H4Cl2N4O2/c7-4-3(9-1-13)5(8)12-6(11-4)10-2-14/h1-2H,(H,9,13)(H,10,11,12,14)
InChI Key:
SJUZRTBKERGCTK-UHFFFAOYSA-N
SMILES:
O=CNc1nc(Cl)c(c(n1)Cl)NC=O
EC Number:
686-734-8
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.971g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
235.024g/mol
Monoisotopic Mass:
233.971g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
84A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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