Home Other Building Blocks 101410-18-8
101410-18-8,MFCD06738835
Catalog No.:AA0004CN
101410-18-8 | N-BOC-(S)-Pyrrolidine-2-thiocarboxamide
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250mg
98%
in stock  
$243.00   $170.00
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1g
98%
in stock  
$495.00   $347.00
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Technical Information
Catalog Number:
AA0004CN
Chemical Name:
N-BOC-(S)-Pyrrolidine-2-thiocarboxamide
CAS Number:
101410-18-8
Molecular Formula:
C10H18N2O2S
Molecular Weight:
230.3271
MDL Number:
MFCD06738835
IUPAC Name:
tert-butyl (2S)-2-carbamothioylpyrrolidine-1-carboxylate
InChI:
InChI=1S/C10H18N2O2S/c1-10(2,3)14-9(13)12-6-4-5-7(12)8(11)15/h7H,4-6H2,1-3H3,(H2,11,15)/t7-/m0/s1
InChI Key:
KPAOKCBKJXBXNI-ZETCQYMHSA-N
SMILES:
NC(=S)[C@@H]1CCCN1C(=O)OC(C)(C)C
Properties
Computed Properties
 
Complexity:
273  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
230.109g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
230.326g/mol
Monoisotopic Mass:
230.109g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
87.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  

Synonyms
 
101410-18-8 
(S)-tert-Butyl 2-carbamothioylpyrrolidine-1-carboxylate 
SCHEMBL1118385 
(S)-2-THIOCARBAMOYLPYRROLIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER 
CTK3J9760 
DTXSID60708313 
KS-00000JY9 
ANW-47842 
MFCD06738835 
ZINC14806780 
AKOS015911118 
AKOS015995210 
(S)-2-Thiocarbamoyl-pyrrolidine-1-carboxylic acid tert-butyl ester 
AB28000 
FCH1624871 
QC-3080 
RP27917 
(S)-1-Boc-pyrrolidine-2-carbothioamide 
AJ-65375 
AS-11355 
BC620557 
BR-48662 
N-BOC-(S)-Pyrrolidine-2-thiocarboxamide 
1-Pyrrolidinecarboxylic acid, 2-(aminothioxomethyl)-, 1,1-dimethylethyl ester, (2S)- 
AB0009721 
AX8027116 
DB-058603 
ST2414681 
TC-136587 
(S)-1-(tert-Butoxycarbonyl)prolinethioamide 
AM20070665 
CS-0047030 
FT-0771901 
S-4695 
tert-butyl (2S)-2-carbamothioylpyrrolidine-1-carboxylate 
410T188 
J-505121 
I14-38617 
(2S)-1-(tert-Butyloxycarbonyl)pyrrolidine-2-carbothioamide 
(R)-tert-Butyl 2-carbamothioylpyrrolidine-1-carboxylate 
117175-41-4 
tert-butyl (S)-2-carbamothioylpyrrolidine-1-carboxylate 
TERT-BUTYL 2(S)-THIOCARBAMOYLPYRROLIDINE-1-CARBOXYLATE 
C10H18N2O2S 
KPAOKCBKJXBXNI-ZETCQYMHSA-N 
AK-48662 
Literature
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