Home Halogens 3-chloro-4,4-dimethylpent-2-enenitrile

3-chloro-4,4-dimethylpent-2-enenitrile

CAS No.:
29586-83-2
Catalog Number:
AG01B7EX
Molecular Formula:
C7H10ClN
Molecular Weight:
143.6140
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Product Description
Catalog Number:
AG01B7EX
Chemical Name:
3-chloro-4,4-dimethylpent-2-enenitrile
CAS Number:
29586-83-2
Molecular Formula:
C7H10ClN
Molecular Weight:
143.6140
MDL Number:
MFCD00830175
IUPAC Name:
3-chloro-4,4-dimethylpent-2-enenitrile
InChI:
InChI=1S/C7H10ClN/c1-7(2,3)6(8)4-5-9/h4H,1-3H3
InChI Key:
KCVZJFYFJKNOFD-UHFFFAOYSA-N
SMILES:
N#CC=C(C(C)(C)C)Cl
Properties
Complexity:
165  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.05g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
143.614g/mol
Monoisotopic Mass:
143.05g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.5  
Properties