2,4-dichloro-5H,6H,7H,8H,9H-cyclohepta[d]pyrimidine

2,4-dichloro-5H,6H,7H,8H,9H-cyclohepta[d]pyrimidine

CAS: 76780-96-6

Formula: C9H10Cl2N2

SMILES: ClC1=NC(Cl)=C2CCCCCC2=N1

IUPAC: 2,4-dichloro-5H,6H,7H,8H,9H-cyclohepta[d]pyrimidine

InChI: InChI=1S/C9H10Cl2N2/c10-8-6-4-2-1-3-5-7(6)12-9(11)13-8/h1-5H2

Composition: C (49.79%), H (4.64%), Cl (32.66%), N (12.90%)

Molar Mass: 217.09

Atom Count: 23

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	216.0221037
Formal Charge	0
FSP3	0.56
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	WJMGVBPDXSHYBU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	55.75
Topological Polar Surface Area	25.78
Polarizability	20.85
Ring Count	2
Rotatable Bond Count	0

Suppliers

LabNetwork INC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	1 Day	76780-96-6		$606.15$606.15