Home Other Building Blocks 1-ethynyl-4-methylcyclohexane

1-ethynyl-4-methylcyclohexane

CAS No.:
1566918-82-8
Catalog Number:
AG01BFG3
Molecular Formula:
C9H14
Molecular Weight:
122.2075
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Product Description
Catalog Number:
AG01BFG3
Chemical Name:
1-ethynyl-4-methylcyclohexane
CAS Number:
1566918-82-8
Molecular Formula:
C9H14
Molecular Weight:
122.2075
MDL Number:
MFCD26853284
IUPAC Name:
1-ethynyl-4-methylcyclohexane
InChI:
InChI=1S/C9H14/c1-3-9-6-4-8(2)5-7-9/h1,8-9H,4-7H2,2H3
InChI Key:
DNDPFDVRLMGJIN-UHFFFAOYSA-N
SMILES:
CC1CCC(CC1)C#C
Properties
Complexity:
118  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
122.11g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
122.211g/mol
Monoisotopic Mass:
122.11g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties