Home Halogens (4R-Cis)-6-chloromethyl-2,2-dimethyl-1,3-dioxane-4-acetic acid tert-butyl ester

(4R-Cis)-6-chloromethyl-2,2-dimethyl-1,3-dioxane-4-acetic acid tert-butyl ester

CAS No.:
154026-94-5
Catalog Number:
AG0038XD
Molecular Formula:
C13H23ClO4
Molecular Weight:
278.7723
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$230
- +
5g
95%
In Stock USA
United States
$653
- +
Product Description
Catalog Number:
AG0038XD
Chemical Name:
(4R-Cis)-6-chloromethyl-2,2-dimethyl-1,3-dioxane-4-acetic acid tert-butyl ester
CAS Number:
154026-94-5
Molecular Formula:
C13H23ClO4
Molecular Weight:
278.7723
MDL Number:
MFCD00042050
IUPAC Name:
tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate
InChI:
InChI=1S/C13H23ClO4/c1-12(2,3)18-11(15)7-9-6-10(8-14)17-13(4,5)16-9/h9-10H,6-8H2,1-5H3/t9-,10+/m1/s1
InChI Key:
TXLXWCARAPIXGH-ZJUUUORDSA-N
SMILES:
ClC[C@@H]1C[C@H](CC(=O)OC(C)(C)C)OC(O1)(C)C
Properties
Complexity:
296  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
278.128g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
278.773g/mol
Monoisotopic Mass:
278.128g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties