Name: Name:2-oxo-1-azatricyclo[7.3.1.0,5,13]trideca-5,7,9(13)-triene-7-sulfonyl chloride
Brand: Angene
SKU: AG01A734
Rating: 90 (10 reviews)

2-oxo-1-azatricyclo[7.3.1.0,5,13]trideca-5,7,9(13)-triene-7-sulfonyl chloride

CAS No.:

1267658-50-3

Catalog Number:

AG01A734

Molecular Formula:

C12H12ClNO3S

Molecular Weight:

285.7466

Catalog Number:

AG01A734

Chemical Name:

2-oxo-1-azatricyclo[7.3.1.0,5,13]trideca-5,7,9(13)-triene-7-sulfonyl chloride

CAS Number:

1267658-50-3

Molecular Formula:

C12H12ClNO3S

Molecular Weight:

285.7466

MDL Number:

MFCD19344045

IUPAC Name:

2-oxo-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-7-sulfonyl chloride

InChI:

InChI=1S/C12H12ClNO3S/c13-18(16,17)10-6-8-2-1-5-14-11(15)4-3-9(7-10)12(8)14/h6-7H,1-5H2

InChI Key:

FNNLFVHFCZPETK-UHFFFAOYSA-N

SMILES:

O=C1CCc2c3N1CCCc3cc(c2)S(=O)(=O)Cl

Complexity:

458

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

285.023g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

285.742g/mol

Monoisotopic Mass:

285.023g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

62.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7