Name: Name:3-(4-tert-Butyl-1-pyridinio)propanesulfonate hydrate
Brand: Angene
SKU: AG00EF9W
Rating: 90 (10 reviews)

3-(4-tert-Butyl-1-pyridinio)propanesulfonate hydrate

CAS No.:

570412-84-9

Catalog Number:

AG00EF9W

Molecular Formula:

C12H19NO3S

Molecular Weight:

257.3492

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

>98.0%(HPLC)(N)

1 week

United States

$153

- +

Catalog Number:

AG00EF9W

Chemical Name:

3-(4-tert-Butyl-1-pyridinio)propanesulfonate hydrate

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

Complexity:

305

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

257.109g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

257.348g/mol

Monoisotopic Mass:

257.109g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

69.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8