200,000+ products from a single source!
sales@angenechem.com
Home > Pyridines > 570412-84-9
570412-84-9 | 4-tert-Butyl-1-(3-sulfopropyl)pyridiniuM Hydroxide Inner Salt [for BiocheMical Research]
CAS No: 570412-84-9 Catalog No: AG00EF9W MDL No:MFCD06411435
Product Description
Catalog Number:
AG00EF9W
Chemical Name:
4-tert-Butyl-1-(3-sulfopropyl)pyridiniuM Hydroxide Inner Salt [for BiocheMical Research]
CAS Number:
570412-84-9
Molecular Formula:
C12H19NO3S
Molecular Weight:
257.3492
MDL Number:
MFCD06411435
IUPAC Name:
3-(4-tert-butylpyridin-1-ium-1-yl)propane-1-sulfonate
InChI:
InChI=1S/C12H19NO3S/c1-12(2,3)11-5-8-13(9-6-11)7-4-10-17(14,15)16/h5-6,8-9H,4,7,10H2,1-3H3
InChI Key:
QMGYGZCGWOKPGR-UHFFFAOYSA-N
SMILES:
CC(c1cc[n+](cc1)CCCS(=O)(=O)[O-])(C)C
Properties
Complexity:
305
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.109g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.348g/mol
Monoisotopic Mass:
257.109g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
69.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.