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56181-39-6 | 4-Chloro-5-Bromopyrimidine
CAS No: 56181-39-6 Catalog No: AG00372F MDL No:MFCD09750158
Product Description
Catalog Number:
AG00372F
Chemical Name:
4-Chloro-5-Bromopyrimidine
CAS Number:
56181-39-6
Molecular Formula:
C4H2BrClN2
Molecular Weight:
193.4291
MDL Number:
MFCD09750158
IUPAC Name:
5-bromo-4-chloropyrimidine
InChI:
InChI=1S/C4H2BrClN2/c5-3-1-7-2-8-4(3)6/h1-2H
InChI Key:
WTVLUSWQWGHYIS-UHFFFAOYSA-N
SMILES:
Brc1cncnc1Cl
Properties
Complexity:
80.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.909g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.428g/mol
Monoisotopic Mass:
191.909g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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