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1252597-70-8 | 2-Pyrazinamine, 3-chloro-5-iodo-
CAS No: 1252597-70-8 Catalog No: AG000NEO MDL No:MFCD14706048
Product Description
Catalog Number:
AG000NEO
Chemical Name:
2-Pyrazinamine, 3-chloro-5-iodo-
CAS Number:
1252597-70-8
Molecular Formula:
C4H3ClIN3
Molecular Weight:
255.4442
MDL Number:
MFCD14706048
IUPAC Name:
3-chloro-5-iodopyrazin-2-amine
InChI:
InChI=1S/C4H3ClIN3/c5-3-4(7)8-1-2(6)9-3/h1H,(H2,7,8)
InChI Key:
KVGKDDCJSHJYCS-UHFFFAOYSA-N
SMILES:
Ic1cnc(c(n1)Cl)N
Properties
Complexity:
102
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.906g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
255.443g/mol
Monoisotopic Mass:
254.906g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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