Home Carboxys tert-butyl 3-{[(2-hydroxyethyl)sulfanyl]methyl}azetidine-1-carboxylate

tert-butyl 3-{[(2-hydroxyethyl)sulfanyl]methyl}azetidine-1-carboxylate

CAS No.:
2059937-86-7
Catalog Number:
AG01BVFQ
Molecular Formula:
C11H21NO3S
Molecular Weight:
247.3543
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Product Description
Catalog Number:
AG01BVFQ
Chemical Name:
tert-butyl 3-{[(2-hydroxyethyl)sulfanyl]methyl}azetidine-1-carboxylate
CAS Number:
2059937-86-7
Molecular Formula:
C11H21NO3S
Molecular Weight:
247.3543
MDL Number:
MFCD30497581
IUPAC Name:
tert-butyl 3-(2-hydroxyethylsulfanylmethyl)azetidine-1-carboxylate
InChI:
InChI=1S/C11H21NO3S/c1-11(2,3)15-10(14)12-6-9(7-12)8-16-5-4-13/h9,13H,4-8H2,1-3H3
InChI Key:
NSNLJIYJIIFTHC-UHFFFAOYSA-N
SMILES:
OCCSCC1CN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.124g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
247.353g/mol
Monoisotopic Mass:
247.124g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
75.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties