Name: Name:1,2-Propanediol, 3-azido-, 1-(4-methylbenzenesulfonate)
Brand: Angene
SKU: AG001Y2H
Rating: 90 (10 reviews)

1,2-Propanediol, 3-azido-, 1-(4-methylbenzenesulfonate)

CAS No.:

168431-73-0

Catalog Number:

AG001Y2H

Molecular Formula:

C10H13N3O4S

Molecular Weight:

271.2929

Catalog Number:

AG001Y2H

Chemical Name:

1,2-Propanediol, 3-azido-, 1-(4-methylbenzenesulfonate)

CAS Number:

168431-73-0

Molecular Formula:

C10H13N3O4S

Molecular Weight:

271.2929

MDL Number:

MFCD02179400

IUPAC Name:

(3-azido-2-hydroxypropyl) 4-methylbenzenesulfonate

InChI:

InChI=1S/C10H13N3O4S/c1-8-2-4-10(5-3-8)18(15,16)17-7-9(14)6-12-13-11/h2-5,9,14H,6-7H2,1H3

InChI Key:

GSOZMIFQWCNBHZ-UHFFFAOYSA-N

SMILES:

OC(CN=[N+]=[N-])COS(=O)(=O)c1ccc(cc1)C

Complexity:

392

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

271.063g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

271.291g/mol

Monoisotopic Mass:

271.063g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

86.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9