200,000+ products from a single source!
sales@angenechem.com
100028-43-1 | Piperidinium, 1-[2-[cyclohexyl(phenylmethyl)amino]ethyl]-1-methyl-, bromide (1:1)
CAS No: 100028-43-1 Catalog No: AG0000C1 MDL No:
Product Description
Catalog Number:
AG0000C1
Chemical Name:
Piperidinium, 1-[2-[cyclohexyl(phenylmethyl)amino]ethyl]-1-methyl-, bromide (1:1)
CAS Number:
100028-43-1
Molecular Formula:
C21H35BrN2
Molecular Weight:
395.4200
IUPAC Name:
N-benzyl-N-[2-(1-methylpiperidin-1-ium-1-yl)ethyl]cyclohexanamine;bromide
InChI:
InChI=1S/C21H35N2.BrH/c1-23(16-9-4-10-17-23)18-15-22(21-13-7-3-8-14-21)19-20-11-5-2-6-12-20;/h2,5-6,11-12,21H,3-4,7-10,13-19H2,1H3;1H/q+1;/p-1
InChI Key:
SZCBJZUSGAZCDH-UHFFFAOYSA-M
SMILES:
C[N+]1(CCCCC1)CCN(C1CCCCC1)Cc1ccccc1.[Br-]
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
394.198g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
395.429g/mol
Monoisotopic Mass:
394.198g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.