Name: Name:2-(2-(2-(2-(Nitrooxy)ethoxy)ethoxy)ethoxy)ethyl 4-methylbenzenesulfonate
Brand: Angene
SKU: AG01EN38
Rating: 90 (10 reviews)

2-(2-(2-(2-(Nitrooxy)ethoxy)ethoxy)ethoxy)ethyl 4-methylbenzenesulfonate

CAS No.:

1973503-48-8

Catalog Number:

AG01EN38

Molecular Formula:

C15H23NO9S

Molecular Weight:

393.4094

Catalog Number:

AG01EN38

Chemical Name:

2-(2-(2-(2-(Nitrooxy)ethoxy)ethoxy)ethoxy)ethyl 4-methylbenzenesulfonate

CAS Number:

1973503-48-8

Molecular Formula:

C15H23NO9S

Molecular Weight:

393.4094

MDL Number:

MFCD30342473

IUPAC Name:

2-[2-[2-(2-nitrooxyethoxy)ethoxy]ethoxy]ethyl 4-methylbenzenesulfonate

InChI:

InChI=1S/C15H23NO9S/c1-14-2-4-15(5-3-14)26(19,20)25-13-11-23-9-7-21-6-8-22-10-12-24-16(17)18/h2-5H,6-13H2,1H3

InChI Key:

ASDJZXSKXRNBTO-UHFFFAOYSA-N

SMILES:

[O-][N+](=O)OCCOCCOCCOCCOS(=O)(=O)c1ccc(cc1)C

Complexity:

467

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

393.109g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

393.407g/mol

Monoisotopic Mass:

393.109g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

135A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3