200,000+ products from a single source!

sales@angenechem.com

Home > Thiazole > 14953-97-0

14953-97-0

14953-97-0 | 1,4-Benzothiazepine, 2,3,4,5-tetrahydro-, hydrochloride (1:1)

CAS No: 14953-97-0 Catalog No: AG001LT9 MDL No:MFCD22205718

Product Description

Catalog Number:
AG001LT9
Chemical Name:
1,4-Benzothiazepine, 2,3,4,5-tetrahydro-, hydrochloride (1:1)
CAS Number:
14953-97-0
Molecular Formula:
C9H12ClNS
Molecular Weight:
201.7163
MDL Number:
MFCD22205718
IUPAC Name:
2,3,4,5-tetrahydro-1,4-benzothiazepine;hydrochloride
InChI:
InChI=1S/C9H11NS.ClH/c1-2-4-9-8(3-1)7-10-5-6-11-9;/h1-4,10H,5-7H2;1H
InChI Key:
MHQHPDMXJONCGP-UHFFFAOYSA-N
SMILES:
C1CSc2c(CN1)cccc2.Cl

Properties

Complexity:
127  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.038g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
201.712g/mol
Monoisotopic Mass:
201.038g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Related Products

© 2019 Angene International Limited. All rights Reserved.