Home Other Building Blocks 1-ethynylcyclohexyl methyl carbonate

1-ethynylcyclohexyl methyl carbonate

CAS No.:
61699-43-2
Catalog Number:
AG01EMU4
Molecular Formula:
C10H14O3
Molecular Weight:
182.2164
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Product Description
Catalog Number:
AG01EMU4
Chemical Name:
1-ethynylcyclohexyl methyl carbonate
CAS Number:
61699-43-2
Molecular Formula:
C10H14O3
Molecular Weight:
182.2164
MDL Number:
MFCD30599226
IUPAC Name:
(1-ethynylcyclohexyl) methyl carbonate
InChI:
InChI=1S/C10H14O3/c1-3-10(13-9(11)12-2)7-5-4-6-8-10/h1H,4-8H2,2H3
InChI Key:
DUKYMIANLXOGEL-UHFFFAOYSA-N
SMILES:
COC(=O)OC1(CCCCC1)C#C
Properties
Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.094g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.219g/mol
Monoisotopic Mass:
182.094g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties