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91990-72-6 | Carbamic acid, cyclohexyl-, 2-methoxy-4-(2-propenyl)phenyl ester
CAS No: 91990-72-6 Catalog No: AG006GJJ MDL No:
Product Description
Catalog Number:
AG006GJJ
Chemical Name:
Carbamic acid, cyclohexyl-, 2-methoxy-4-(2-propenyl)phenyl ester
CAS Number:
91990-72-6
Molecular Formula:
C17H23NO3
Molecular Weight:
289.3694
IUPAC Name:
(2-methoxy-4-prop-2-enylphenyl) N-cyclohexylcarbamate
InChI:
InChI=1S/C17H23NO3/c1-3-7-13-10-11-15(16(12-13)20-2)21-17(19)18-14-8-5-4-6-9-14/h3,10-12,14H,1,4-9H2,2H3,(H,18,19)
InChI Key:
AZBFFBXKJFKUAQ-UHFFFAOYSA-N
SMILES:
C=CCc1ccc(c(c1)OC)OC(=O)NC1CCCCC1
Properties
Complexity:
339
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.168g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
289.375g/mol
Monoisotopic Mass:
289.168g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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