200,000+ products from a single source!
sales@angenechem.com
Home > Fluorides > 850053-04-2
850053-04-2 | Naphthalene, 7-butoxy-3-[2-(trans-4-ethylcyclohexyl)ethyl]-1,2,8-trifluoro-
CAS No: 850053-04-2 Catalog No: AG004QCR MDL No:
Product Description
Catalog Number:
AG004QCR
Chemical Name:
Naphthalene, 7-butoxy-3-[2-(trans-4-ethylcyclohexyl)ethyl]-1,2,8-trifluoro-
CAS Number:
850053-04-2
Molecular Formula:
C24H31F3O
Molecular Weight:
392.4975
IUPAC Name:
7-butoxy-3-[2-(4-ethylcyclohexyl)ethyl]-1,2,8-trifluoronaphthalene
InChI:
InChI=1S/C24H31F3O/c1-3-5-14-28-20-13-12-18-15-19(22(25)24(27)21(18)23(20)26)11-10-17-8-6-16(4-2)7-9-17/h12-13,15-17H,3-11,14H2,1-2H3
InChI Key:
LYMYYYIKRKTTRI-UHFFFAOYSA-N
SMILES:
CCCCOc1ccc2c(c1F)c(F)c(c(c2)CC[C@@H]1CC[C@H](CC1)CC)F
Properties
Complexity:
451
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
392.233g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
392.506g/mol
Monoisotopic Mass:
392.233g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.