Name: Name:1,4-Diazabicyclo[2.2.2]octane 4-methylbenzenesulfonate
Brand: Angene
SKU: AG00I6XI
Rating: 90 (10 reviews)

1,4-Diazabicyclo[2.2.2]octane 4-methylbenzenesulfonate

CAS No.:

34985-57-4

Catalog Number:

AG00I6XI

Molecular Formula:

C13H20N2O3S

Molecular Weight:

284.3745

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

95%

In Stock USA

United States

$54

- +

95%

In Stock USA

United States

$164

- +

Catalog Number:

AG00I6XI

Chemical Name:

1,4-Diazabicyclo[2.2.2]octane 4-methylbenzenesulfonate

CAS Number:

34985-57-4

Molecular Formula:

C13H20N2O3S

Molecular Weight:

284.3745

MDL Number:

MFCD28991719

IUPAC Name:

1,4-diazabicyclo[2.2.2]octane;4-methylbenzenesulfonic acid

InChI:

InChI=1S/C7H8O3S.C6H12N2/c1-6-2-4-7(5-3-6)11(8,9)10;1-2-8-5-3-7(1)4-6-8/h2-5H,1H3,(H,8,9,10);1-6H2

InChI Key:

FMQZSJVCHOHXQH-UHFFFAOYSA-N

SMILES:

C1CN2CCN1CC2.Cc1ccc(cc1)S(=O)(=O)O

Complexity:

268

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

284.119g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

284.374g/mol

Monoisotopic Mass:

284.119g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

69.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: