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1018818-04-6,MFCD23105992
Catalog No.:AA0005QU
1018818-04-6 | (2R,4S)-1-Boc-4-methylpyrrolidine-2-carboxylic acid
Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
97%
in stock  
$300.00   $210.00
- +
250mg
97%
in stock  
$479.00   $336.00
- +
500mg
97%
in stock  
$797.00   $558.00
- +
1g
97%
in stock  
$1,195.00   $836.00
- +
  • Technical Information
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  • Technical Information
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Technical Information
Catalog Number:
AA0005QU
Chemical Name:
(2R,4S)-1-Boc-4-methylpyrrolidine-2-carboxylic acid
CAS Number:
1018818-04-6
Molecular Formula:
C11H18NO4-
Molecular Weight:
228.2649
MDL Number:
MFCD23105992
IUPAC Name:
(2R,4S)-4-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
InChI:
InChI=1S/C11H19NO4/c1-7-5-8(9(13)14)12(6-7)10(15)16-11(2,3)4/h7-8H,5-6H2,1-4H3,(H,13,14)/t7-,8+/m0/s1
InChI Key:
MXKSXPYZNXUHEZ-JGVFFNPUSA-N
SMILES:
C[[email protected]@H]1CN([[email protected]](C1)C(=O)[O-])C(=O)OC(C)(C)C
Properties
Computed Properties
 
Complexity:
295  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
229.131g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
229.276g/mol
Monoisotopic Mass:
229.131g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

Synonyms
 
1018818-04-6 
(2R,4S)-1-Boc-4-methylpyrrolidine-2-carboxylic acid 
FCH3872609 
PB36034 
SB20677 
AK172083 
AS-34702 
(2R,4S)-1-[(tert-butoxy)carbonyl]-4- 
CS-0053464 
Q-4029 
(2R,4S)-1-tert-butoxycarbonyl-4-methylpyrrolidine-2-carboxylic acid 
(2R,4S)-1-tert-Butoxycarbonyl-4-methyl-pyrrolidine-2-carboxylic acid 
(2R,4S)-1-(tert-Butoxycarbonyl)-4-methylpyrrolidine-2-carboxylic acid 
methylpyrrolidine-2-carboxylic acid 
(2r,4s)-1-[(tert-butoxy)carbonyl]-4-methylpyrrolidine-2-carboxylic acid 
SCHEMBL3442335 
MXKSXPYZNXUHEZ-JGVFFNPUSA-N 
KS-000007HM 
MFCD23105992 
ZINC32098873 
AKOS025290023 
Literature
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