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1158758-85-0 | 1-Azetidinecarboxylic acid, 3-(aminomethyl)-3-methyl-, 1,1-dimethylethyl ester
CAS No: 1158758-85-0 Catalog No: AG000H11 MDL No:MFCD12408560
Product Description
Catalog Number:
AG000H11
Chemical Name:
1-Azetidinecarboxylic acid, 3-(aminomethyl)-3-methyl-, 1,1-dimethylethyl ester
CAS Number:
1158758-85-0
Molecular Formula:
C10H20N2O2
Molecular Weight:
200.2780
MDL Number:
MFCD12408560
IUPAC Name:
tert-butyl 3-(aminomethyl)-3-methylazetidine-1-carboxylate
InChI:
InChI=1S/C10H20N2O2/c1-9(2,3)14-8(13)12-6-10(4,5-11)7-12/h5-7,11H2,1-4H3
InChI Key:
NUSZXESXGDKVCH-UHFFFAOYSA-N
SMILES:
NCC1(C)CN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.152g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
200.282g/mol
Monoisotopic Mass:
200.152g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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