200,000+ products from a single source!
sales@angenechem.com
Home > Bromides > 1392803-79-0
1392803-79-0 | 1-Azetidinecarboxylic acid, 3-(5-bromo-3-pyridinyl)-, 1,1-dimethylethyl ester
CAS No: 1392803-79-0 Catalog No: AG001ANC MDL No:MFCD22573374
Product Description
Catalog Number:
AG001ANC
Chemical Name:
1-Azetidinecarboxylic acid, 3-(5-bromo-3-pyridinyl)-, 1,1-dimethylethyl ester
CAS Number:
1392803-79-0
Molecular Formula:
C13H17BrN2O2
Molecular Weight:
313.1903
MDL Number:
MFCD22573374
IUPAC Name:
tert-butyl 3-(5-bromopyridin-3-yl)azetidine-1-carboxylate
InChI:
InChI=1S/C13H17BrN2O2/c1-13(2,3)18-12(17)16-7-10(8-16)9-4-11(14)6-15-5-9/h4-6,10H,7-8H2,1-3H3
InChI Key:
DZRFCPPUTVBPAY-UHFFFAOYSA-N
SMILES:
Brc1cncc(c1)C1CN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.047g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
313.195g/mol
Monoisotopic Mass:
312.047g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.