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5,6-dichloro-2-propyl-1H-1,3-benzodiazole

5,6-dichloro-2-propyl-1H-1,3-benzodiazole

CAS: 176949-20-5

Formula: C10H10Cl2N2

SMILES: CCCC1=NC2=CC(Cl)=C(Cl)C=C2N1

IUPAC: 5,6-dichloro-2-propyl-1H-1,3-benzodiazole

InChI: InChI=1S/C10H10Cl2N2/c1-2-3-10-13-8-4-6(11)7(12)5-9(8)14-10/h4-5H,2-3H2,1H3,(H,13,14)

Composition: C (52.43%), H (4.40%), Cl (30.95%), N (12.23%)

Molar Mass: 229.1

Atom Count: 24

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 228.0221037
Formal Charge 0
FSP3 0.3
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey OEFVYUZIGAGWJB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 58.25
Topological Polar Surface Area 28.68
Polarizability 23.85
Ring Count 2
Rotatable Bond Count 2

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Key Organics Ltd
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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 176949-20-5 $51.35-$113.62$51.35$63.37$86.31$113.62
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Struchem co.,ltd
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95% <5 Days 176949-20-5 $1,001.00-$1,700.00$1,001.00$1,140.00$1,700.00
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