200,000+ products from a single source!

sales@angenechem.com

Home > Other Building Blocks > 6807-18-7

6807-18-7

6807-18-7 | 4,4'-(1-METHYLOCTYLIDENE)BISPHENOL

CAS No: 6807-18-7 Catalog No: AG006G2Z MDL No:

Product Description

Catalog Number:
AG006G2Z
Chemical Name:
4,4'-(1-METHYLOCTYLIDENE)BISPHENOL
CAS Number:
6807-18-7
Molecular Formula:
C21H28O2
Molecular Weight:
312.4458
IUPAC Name:
4-[2-(4-hydroxyphenyl)nonan-2-yl]phenol
InChI:
InChI=1S/C21H28O2/c1-3-4-5-6-7-16-21(2,17-8-12-19(22)13-9-17)18-10-14-20(23)15-11-18/h8-15,22-23H,3-7,16H2,1-2H3
InChI Key:
KBWOAGGPYKQCAO-UHFFFAOYSA-N
SMILES:
CCCCCCCC(c1ccc(cc1)O)(c1ccc(cc1)O)C
EC Number:
229-882-7

Properties

Complexity:
290  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.209g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
312.453g/mol
Monoisotopic Mass:
312.209g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.6  

© 2019 Angene International Limited. All rights Reserved.