Home Halogens (S)-3-(Boc-amino)-1-chloro-2-butanone

(S)-3-(Boc-amino)-1-chloro-2-butanone

CAS No.:
93371-30-3
Catalog Number:
AG0032GY
Molecular Formula:
C9H16ClNO3
Molecular Weight:
221.6812
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$232
- +
1g
97%
1 week
United States
$524
- +
5g
97%
1 week
United States
$1739
- +
Product Description
Catalog Number:
AG0032GY
Chemical Name:
(S)-3-(Boc-amino)-1-chloro-2-butanone
CAS Number:
93371-30-3
Molecular Formula:
C9H16ClNO3
Molecular Weight:
221.6812
MDL Number:
MFCD23381107
IUPAC Name:
tert-butyl N-[(2S)-4-chloro-3-oxobutan-2-yl]carbamate
InChI:
InChI=1S/C9H16ClNO3/c1-6(7(12)5-10)11-8(13)14-9(2,3)4/h6H,5H2,1-4H3,(H,11,13)/t6-/m0/s1
InChI Key:
SUMIWORFUZTLFW-LURJTMIESA-N
SMILES:
ClCC(=O)[C@@H](NC(=O)OC(C)(C)C)C
Properties
Complexity:
223  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
221.082g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.681g/mol
Monoisotopic Mass:
221.082g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties