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24889-11-0 | Propanenitrile, 2-(4-chlorophenoxy)-2-methyl-
CAS No: 24889-11-0 Catalog No: AG002PQP MDL No:MFCD00203862
Product Description
Catalog Number:
AG002PQP
Chemical Name:
Propanenitrile, 2-(4-chlorophenoxy)-2-methyl-
CAS Number:
24889-11-0
Molecular Formula:
C10H10ClNO
Molecular Weight:
195.6455
MDL Number:
MFCD00203862
IUPAC Name:
2-(4-chlorophenoxy)-2-methylpropanenitrile
InChI:
InChI=1S/C10H10ClNO/c1-10(2,7-12)13-9-5-3-8(11)4-6-9/h3-6H,1-2H3
InChI Key:
JENFRDUXBGWJGH-UHFFFAOYSA-N
SMILES:
N#CC(Oc1ccc(cc1)Cl)(C)C
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.045g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.646g/mol
Monoisotopic Mass:
195.045g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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