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130190-00-0

130190-00-0 | 2-Propynoic acid, 2-cyclohexen-1-yl ester

CAS No: 130190-00-0 Catalog No: AG000U3Z MDL No:

Product Description

Catalog Number:
AG000U3Z
Chemical Name:
2-Propynoic acid, 2-cyclohexen-1-yl ester
CAS Number:
130190-00-0
Molecular Formula:
C9H10O2
Molecular Weight:
150.1745
IUPAC Name:
cyclohex-2-en-1-yl prop-2-ynoate
InChI:
InChI=1S/C9H10O2/c1-2-9(10)11-8-6-4-3-5-7-8/h1,4,6,8H,3,5,7H2
InChI Key:
AZXMRFVZSIBHEQ-UHFFFAOYSA-N
SMILES:
C1CCC=CC1OC(=O)C#C

Properties

Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.068g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
150.177g/mol
Monoisotopic Mass:
150.068g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

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