200,000+ products from a single source!
sales@angenechem.com
Home > Bromides > 1093064-85-7
1093064-85-7 | 1-Piperidinecarboxylic acid, 4-(4-bromophenyl)-4-fluoro-, 1,1-dimethylethyl ester
CAS No: 1093064-85-7 Catalog No: AG01EQQD MDL No:
Product Description
Catalog Number:
AG01EQQD
Chemical Name:
1-Piperidinecarboxylic acid, 4-(4-bromophenyl)-4-fluoro-, 1,1-dimethylethyl ester
CAS Number:
1093064-85-7
Molecular Formula:
C16H21BrFNO2
Molecular Weight:
358.2458
IUPAC Name:
tert-butyl 4-(4-bromophenyl)-4-fluoropiperidine-1-carboxylate
InChI:
InChI=1S/C16H21BrFNO2/c1-15(2,3)21-14(20)19-10-8-16(18,9-11-19)12-4-6-13(17)7-5-12/h4-7H,8-11H2,1-3H3
InChI Key:
IJAXYEOEPQQWCO-UHFFFAOYSA-N
SMILES:
O=C(N1CCC(CC1)(F)c1ccc(cc1)Br)OC(C)(C)C
Properties
Complexity:
367
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
357.074g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
358.251g/mol
Monoisotopic Mass:
357.074g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.