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1026796-78-0 | 1-Azetidinecarboxylic acid, 3-ethenyl-, 1,1-dimethylethyl ester
CAS No: 1026796-78-0 Catalog No: AG000835 MDL No:MFCD16140212
Product Description
Catalog Number:
AG000835
Chemical Name:
1-Azetidinecarboxylic acid, 3-ethenyl-, 1,1-dimethylethyl ester
CAS Number:
1026796-78-0
Molecular Formula:
C10H17NO2
Molecular Weight:
183.2475
MDL Number:
MFCD16140212
IUPAC Name:
tert-butyl 3-ethenylazetidine-1-carboxylate
InChI:
InChI=1S/C10H17NO2/c1-5-8-6-11(7-8)9(12)13-10(2,3)4/h5,8H,1,6-7H2,2-4H3
InChI Key:
YASOUSGMWNLROI-UHFFFAOYSA-N
SMILES:
C=CC1CN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.126g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.251g/mol
Monoisotopic Mass:
183.126g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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