Name: Name:(Tetrahydro-2H-pyran-2-yl)methyl 4-methylbenzenesulfonate
Brand: Angene
SKU: AG008Q3J
Rating: 90 (10 reviews)

(Tetrahydro-2H-pyran-2-yl)methyl 4-methylbenzenesulfonate

CAS No.:

75434-63-8

Catalog Number:

AG008Q3J

Molecular Formula:

C13H18O4S

Molecular Weight:

270.3446

Catalog Number:

AG008Q3J

Chemical Name:

(Tetrahydro-2H-pyran-2-yl)methyl 4-methylbenzenesulfonate

CAS Number:

75434-63-8

Molecular Formula:

C13H18O4S

Molecular Weight:

270.3446

MDL Number:

MFCD16618477

IUPAC Name:

oxan-2-ylmethyl 4-methylbenzenesulfonate

InChI:

InChI=1S/C13H18O4S/c1-11-5-7-13(8-6-11)18(14,15)17-10-12-4-2-3-9-16-12/h5-8,12H,2-4,9-10H2,1H3

InChI Key:

YNBDZQRMEDQOQM-UHFFFAOYSA-N

SMILES:

Cc1ccc(cc1)S(=O)(=O)OCC1CCCCO1

Complexity:

339

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

270.093g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

270.343g/mol

Monoisotopic Mass:

270.093g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

61A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3