Home Other Building Blocks 2-(3,4-DICHLOROPHENYL)-2-METHYLPROPANENITRILE

2-(3,4-DICHLOROPHENYL)-2-METHYLPROPANENITRILE

CAS No.:
80854-24-6
Catalog Number:
AG01DWOG
Molecular Formula:
C10H9Cl2N
Molecular Weight:
214.0912
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Product Description
Catalog Number:
AG01DWOG
Chemical Name:
2-(3,4-DICHLOROPHENYL)-2-METHYLPROPANENITRILE
CAS Number:
80854-24-6
Molecular Formula:
C10H9Cl2N
Molecular Weight:
214.0912
MDL Number:
MFCD11036580
IUPAC Name:
2-(3,4-dichlorophenyl)-2-methylpropanenitrile
InChI:
InChI=1S/C10H9Cl2N/c1-10(2,6-13)7-3-4-8(11)9(12)5-7/h3-5H,1-2H3
InChI Key:
YRQZPEHIUCAMMP-UHFFFAOYSA-N
SMILES:
N#CC(c1ccc(c(c1)Cl)Cl)(C)C
Properties
Complexity:
228  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.011g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.089g/mol
Monoisotopic Mass:
213.011g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Properties