Home Other Building Blocks 1-ethynyl-1-methylcyclopentane

1-ethynyl-1-methylcyclopentane

CAS No.:
28509-11-7
Catalog Number:
AG01BR5J
Molecular Formula:
C8H12
Molecular Weight:
108.1809
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Product Description
Catalog Number:
AG01BR5J
Chemical Name:
1-ethynyl-1-methylcyclopentane
CAS Number:
28509-11-7
Molecular Formula:
C8H12
Molecular Weight:
108.1809
MDL Number:
MFCD30502237
IUPAC Name:
1-ethynyl-1-methylcyclopentane
InChI:
InChI=1S/C8H12/c1-3-8(2)6-4-5-7-8/h1H,4-7H2,2H3
InChI Key:
NNGMTMULEKGSTL-UHFFFAOYSA-N
SMILES:
C#CC1(C)CCCC1
Properties
Complexity:
118  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
108.094g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
108.184g/mol
Monoisotopic Mass:
108.094g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties