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PENTAMETHYLBENZONITRILE

CAS No.:
5144-10-5
Catalog Number:
AG003TLV
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG003TLV
Chemical Name:
PENTAMETHYLBENZONITRILE
CAS Number:
5144-10-5
MDL Number:
MFCD00015450
IUPAC Name:
2,3,4,5,6-pentamethylbenzonitrile
InChI:
InChI=1S/C12H15N/c1-7-8(2)10(4)12(6-13)11(5)9(7)3/h1-5H3
InChI Key:
NCDPYDGGUAKABA-UHFFFAOYSA-N
EC Number:
225-912-8
Properties
Complexity:
209  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.12g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.259g/mol
Monoisotopic Mass:
173.12g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties