Home Halogens 6-chloro-2-cyclopropylpyrimidine-4-carbonitrile

6-chloro-2-cyclopropylpyrimidine-4-carbonitrile

CAS No.:
2059992-99-1
Catalog Number:
AG01BVRD
Molecular Formula:
C8H6ClN3
Molecular Weight:
179.6063
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Product Description
Catalog Number:
AG01BVRD
Chemical Name:
6-chloro-2-cyclopropylpyrimidine-4-carbonitrile
CAS Number:
2059992-99-1
Molecular Formula:
C8H6ClN3
Molecular Weight:
179.6063
MDL Number:
MFCD30497638
IUPAC Name:
6-chloro-2-cyclopropylpyrimidine-4-carbonitrile
InChI:
InChI=1S/C8H6ClN3/c9-7-3-6(4-10)11-8(12-7)5-1-2-5/h3,5H,1-2H2
InChI Key:
WHOQUWHDFDZRRP-UHFFFAOYSA-N
SMILES:
N#Cc1cc(Cl)nc(n1)C1CC1
Properties
Complexity:
218  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.025g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.607g/mol
Monoisotopic Mass:
179.025g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
49.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties