Home Carbonyls (S)-3-((tert-Butoxycarbonyl)amino)hex-5-ynoic acid

(S)-3-((tert-Butoxycarbonyl)amino)hex-5-ynoic acid

CAS No.:
270596-47-9
Catalog Number:
AG003OF3
Molecular Formula:
C11H17NO4
Molecular Weight:
227.2570
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
≥ 97% (NMR)
1 week
United States
$184
- +
250mg
≥ 97% (NMR)
1 week
United States
$330
- +
1g
≥ 97% (NMR)
1 week
United States
$615
- +
Product Description
Catalog Number:
AG003OF3
Chemical Name:
(S)-3-((tert-Butoxycarbonyl)amino)hex-5-ynoic acid
CAS Number:
270596-47-9
Molecular Formula:
C11H17NO4
Molecular Weight:
227.2570
MDL Number:
MFCD01861007
IUPAC Name:
(3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]hex-5-ynoic acid
InChI:
InChI=1S/C11H17NO4/c1-5-6-8(7-9(13)14)12-10(15)16-11(2,3)4/h1,8H,6-7H2,2-4H3,(H,12,15)(H,13,14)/t8-/m0/s1
InChI Key:
QZRLAJLEZVWLOV-QMMMGPOBSA-N
SMILES:
C#CC[C@H](NC(=O)OC(C)(C)C)CC(=O)O
Properties
Complexity:
308  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
227.116g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
227.26g/mol
Monoisotopic Mass:
227.116g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties