Home Other Building Blocks Acetic acid, 2-(4-phenylcyclohexylidene)-, ethyl ester

Acetic acid, 2-(4-phenylcyclohexylidene)-, ethyl ester

CAS No.:
115880-04-1
Catalog Number:
AG000H1Q
Molecular Formula:
C16H20O2
Molecular Weight:
244.3288
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Product Description
Catalog Number:
AG000H1Q
Chemical Name:
Acetic acid, 2-(4-phenylcyclohexylidene)-, ethyl ester
CAS Number:
115880-04-1
Molecular Formula:
C16H20O2
Molecular Weight:
244.3288
MDL Number:
MFCD13181210
IUPAC Name:
ethyl 2-(4-phenylcyclohexylidene)acetate
InChI:
InChI=1S/C16H20O2/c1-2-18-16(17)12-13-8-10-15(11-9-13)14-6-4-3-5-7-14/h3-7,12,15H,2,8-11H2,1H3
InChI Key:
PESXGYQEFGRNJR-UHFFFAOYSA-N
SMILES:
CCOC(=O)C=C1CCC(CC1)c1ccccc1
Properties
Complexity:
290  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.146g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.334g/mol
Monoisotopic Mass:
244.146g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties