200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 164649-96-1
164649-96-1 | 1,3-Dioxane, 2,2-dimethyl-4-[2-(phenylmethoxy)ethyl]-, (4S)-
CAS No: 164649-96-1 Catalog No: AG001V0I MDL No:
Product Description
Catalog Number:
AG001V0I
Chemical Name:
1,3-Dioxane, 2,2-dimethyl-4-[2-(phenylmethoxy)ethyl]-, (4S)-
CAS Number:
164649-96-1
Molecular Formula:
C15H22O3
Molecular Weight:
250.3334
IUPAC Name:
(4S)-2,2-dimethyl-4-(2-phenylmethoxyethyl)-1,3-dioxane
InChI:
InChI=1S/C15H22O3/c1-15(2)17-11-9-14(18-15)8-10-16-12-13-6-4-3-5-7-13/h3-7,14H,8-12H2,1-2H3/t14-/m0/s1
InChI Key:
JKLSLDYXJULKDK-AWEZNQCLSA-N
SMILES:
CC1(C)OCC[C@@H](O1)CCOCc1ccccc1
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
250.157g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.338g/mol
Monoisotopic Mass:
250.157g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.