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1363382-00-6 | 1,3-Azetidinedicarboxylic acid, 3-fluoro-, 1-(1,1-dimethylethyl) 3-methyl ester
CAS No: 1363382-00-6 Catalog No: AG0011P3 MDL No:MFCD20922778
Product Description
Catalog Number:
AG0011P3
Chemical Name:
1,3-Azetidinedicarboxylic acid, 3-fluoro-, 1-(1,1-dimethylethyl) 3-methyl ester
CAS Number:
1363382-00-6
Molecular Formula:
C10H16FNO4
Molecular Weight:
233.2367
MDL Number:
MFCD20922778
IUPAC Name:
1-O-tert-butyl 3-O-methyl 3-fluoroazetidine-1,3-dicarboxylate
InChI:
InChI=1S/C10H16FNO4/c1-9(2,3)16-8(14)12-5-10(11,6-12)7(13)15-4/h5-6H2,1-4H3
InChI Key:
NBYZMANWZNNZDT-UHFFFAOYSA-N
SMILES:
COC(=O)C1(F)CN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.106g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.239g/mol
Monoisotopic Mass:
233.106g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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