Home Carbonyls tert-Butoxycarbonylamino-(4,4-difluoro-cyclohexyl)-acetic acid

tert-Butoxycarbonylamino-(4,4-difluoro-cyclohexyl)-acetic acid

CAS No.:
394735-65-0
Catalog Number:
AG00I7RK
Molecular Formula:
C13H21F2NO4
Molecular Weight:
293.3069
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$712
- +
1g
97%
1 week
United States
$1182
- +
5g
97%
1 week
United States
$3471
- +
10g
97%
1 week
United States
$5760
- +
Product Description
Catalog Number:
AG00I7RK
Chemical Name:
tert-Butoxycarbonylamino-(4,4-difluoro-cyclohexyl)-acetic acid
CAS Number:
394735-65-0
Molecular Formula:
C13H21F2NO4
Molecular Weight:
293.3069
MDL Number:
MFCD28501990
IUPAC Name:
2-(4,4-difluorocyclohexyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid
InChI:
InChI=1S/C13H21F2NO4/c1-12(2,3)20-11(19)16-9(10(17)18)8-4-6-13(14,15)7-5-8/h8-9H,4-7H2,1-3H3,(H,16,19)(H,17,18)
InChI Key:
JALIUBZVGPQDJB-UHFFFAOYSA-N
SMILES:
OC(=O)[C@H](C1CCC(CC1)(F)F)NC(=O)OC(C)(C)C
Properties
Complexity:
369  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.144g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
293.311g/mol
Monoisotopic Mass:
293.144g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties