Home Amines 1008526-71-3
1008526-71-3,MFCD17015986
Catalog No.:AA0002XG
1008526-71-3 | 1-Azetidinecarboxylic acid, 3-(aminomethyl)-3-hydroxy-, 1,1-dimethylethyl ester
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100mg
95%
in stock  
$27.00
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250mg
95%
in stock  
$51.00
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1g
95%
in stock  
$101.00
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5g
95%
in stock  
$304.00
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10g
95%
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$506.00
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  • Technical Information
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Technical Information
Catalog Number:
AA0002XG
Chemical Name:
1-Azetidinecarboxylic acid, 3-(aminomethyl)-3-hydroxy-, 1,1-dimethylethyl ester
CAS Number:
1008526-71-3
Molecular Formula:
C9H18N2O3
Molecular Weight:
202.2508
MDL Number:
MFCD17015986
IUPAC Name:
tert-butyl 3-(aminomethyl)-3-hydroxyazetidine-1-carboxylate
InChI:
InChI=1S/C9H18N2O3/c1-8(2,3)14-7(12)11-5-9(13,4-10)6-11/h13H,4-6,10H2,1-3H3
InChI Key:
NVEHYSKQUSAZBP-UHFFFAOYSA-N
SMILES:
NCC1(O)CN(C1)C(=O)OC(C)(C)C
Properties
Computed Properties
 
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.132g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
202.254g/mol
Monoisotopic Mass:
202.132g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
75.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9  

Synonyms
 
1008526-71-3 
1-BOC-3-HYDROXY-3-(AMINOMETHYL)AZETIDINE 
AKOS023660592 
PB15264 
AM802830 
AS-33617 
ST1010013 
CS-0039121 
C-8747 
F8888-4402 
tert-Butyl 3-(aminomethyl);-3-hydroxyazetidine-1-carboxylate 
TERT-BUTYL 3-(AMINOMETHYL)-3-HYDROXYAZETIDINE-1-CARBOXYLATE 
1-AZETIDINECARBOXYLIC ACID, 3-(AMINOMETHYL)-3-HYDROXY-, 1,1-DIMETHYLETHYL ESTER 
SCHEMBL1141357 
DTXSID40725583 
NVEHYSKQUSAZBP-UHFFFAOYSA-N 
KS-000003HI 
MFCD17015986 
ZINC72267043 
Literature
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