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2-chloro-5H,6H,7H-cyclopenta[d]pyrimidine

2-chloro-5H,6H,7H-cyclopenta[d]pyrimidine

CAS: 1030377-43-5

Formula: C7H7ClN2

SMILES: ClC1=NC=C2CCCC2=N1

IUPAC: 2-chloro-5H,6H,7H-cyclopenta[d]pyrimidine

InChI: InChI=1S/C7H7ClN2/c8-7-9-4-5-2-1-3-6(5)10-7/h4H,1-3H2

Composition: C (54.38%), H (4.56%), Cl (22.93%), N (18.12%)

Molar Mass: 154.6

Atom Count: 17

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 154.0297759
Formal Charge 0
FSP3 0.43
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey YRPKTWHLIYZWGY-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 40.68
Topological Polar Surface Area 25.78
Polarizability 15.2
Ring Count 2
Rotatable Bond Count 0

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