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119552-44-2 | 1H-Imidazole, 4,5-dichloro-1-(chloromethyl)-
CAS No: 119552-44-2 Catalog No: AG000IYH MDL No:
Product Description
Catalog Number:
AG000IYH
Chemical Name:
1H-Imidazole, 4,5-dichloro-1-(chloromethyl)-
CAS Number:
119552-44-2
Molecular Formula:
C4H3Cl3N2
Molecular Weight:
185.4390
IUPAC Name:
4,5-dichloro-1-(chloromethyl)imidazole
InChI:
InChI=1S/C4H3Cl3N2/c5-1-9-2-8-3(6)4(9)7/h2H,1H2
InChI Key:
LNLXQCZZLGBDKI-UHFFFAOYSA-N
SMILES:
ClCn1cnc(c1Cl)Cl
Properties
Complexity:
99.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.936g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.432g/mol
Monoisotopic Mass:
183.936g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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