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N1-(2,3,4,5,6-pentachlorophenyl)ethane-1,2-diamine

N1-(2,3,4,5,6-pentachlorophenyl)ethane-1,2-diamine

CAS: 3426-65-1

Formula: C8H7Cl5N2

SMILES: NCCNC1=C(Cl)C(Cl)=C(Cl)C(Cl)=C1Cl

IUPAC: N1-(2,3,4,5,6-pentachlorophenyl)ethane-1,2-diamine

InChI: InChI=1S/C8H7Cl5N2/c9-3-4(10)6(12)8(15-2-1-14)7(13)5(3)11/h15H,1-2,14H2

Composition: C (31.16%), H (2.29%), Cl (57.47%), N (9.08%)

Molar Mass: 308.41

Atom Count: 22

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 305.9051867
Formal Charge 0
FSP3 0.25
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey NKIPRDISYSAKLQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 68.23
Topological Polar Surface Area 38.05
Polarizability 26.39
Ring Count 1
Rotatable Bond Count 3

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95% <2 Days 3426-65-1 $202.14$202.14
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