200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 87995-47-9
87995-47-9 | 4-Penten-2-ol, 1-[4-(1,1-dimethylethyl)cyclohexylidene]-2-ethoxy-
CAS No: 87995-47-9 Catalog No: AG004O7M MDL No:
Product Description
Catalog Number:
AG004O7M
Chemical Name:
4-Penten-2-ol, 1-[4-(1,1-dimethylethyl)cyclohexylidene]-2-ethoxy-
CAS Number:
87995-47-9
Molecular Formula:
C17H30O2
Molecular Weight:
266.4189
IUPAC Name:
1-(4-tert-butylcyclohexylidene)-2-ethoxypent-4-en-2-ol
InChI:
InChI=1S/C17H30O2/c1-6-12-17(18,19-7-2)13-14-8-10-15(11-9-14)16(3,4)5/h6,13,15,18H,1,7-12H2,2-5H3
InChI Key:
QOMFWZRSGJJBLB-UHFFFAOYSA-N
SMILES:
C=CCC(C=C1CCC(CC1)C(C)(C)C)(OCC)O
Properties
Complexity:
315
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.225g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
266.425g/mol
Monoisotopic Mass:
266.225g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.