Home Carbonyls (R)-2-((tert-butoxycarbonyl)amino)-3-((cyanomethyl)thio)propanoic acid

(R)-2-((tert-butoxycarbonyl)amino)-3-((cyanomethyl)thio)propanoic acid

CAS No.:
174894-18-9
Catalog Number:
AG01DYVA
Molecular Formula:
C10H16N2O4S
Molecular Weight:
260.3100
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Product Description
Catalog Number:
AG01DYVA
Chemical Name:
(R)-2-((tert-butoxycarbonyl)amino)-3-((cyanomethyl)thio)propanoic acid
CAS Number:
174894-18-9
Molecular Formula:
C10H16N2O4S
Molecular Weight:
260.3100
MDL Number:
MFCD24466507
IUPAC Name:
3-(cyanomethylsulfanyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
InChI:
InChI=1S/C10H16N2O4S/c1-10(2,3)16-9(15)12-7(8(13)14)6-17-5-4-11/h7H,5-6H2,1-3H3,(H,12,15)(H,13,14)
InChI Key:
JHNYJFOVOSZPPP-UHFFFAOYSA-N
SMILES:
N#CCSC[C@@H](C(=O)O)NC(=O)OC(C)(C)C
Properties
Complexity:
329  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.083g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
260.308g/mol
Monoisotopic Mass:
260.083g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
125A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties