Home Other Building Blocks PYRENE-1-SULFONIC ACID SODIUM SALT

PYRENE-1-SULFONIC ACID SODIUM SALT

CAS No.:
59323-54-5
Catalog Number:
AG00EBRJ
Molecular Formula:
C16H9NaO3S
Molecular Weight:
304.2956
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Product Description
Catalog Number:
AG00EBRJ
Chemical Name:
PYRENE-1-SULFONIC ACID SODIUM SALT
CAS Number:
59323-54-5
Molecular Formula:
C16H9NaO3S
Molecular Weight:
304.2956
MDL Number:
MFCD00210088
IUPAC Name:
sodium;pyrene-1-sulfonate
InChI:
InChI=1S/C16H10O3S.Na/c17-20(18,19)14-9-7-12-5-4-10-2-1-3-11-6-8-13(14)16(12)15(10)11;/h1-9H,(H,17,18,19);/q;+1/p-1
InChI Key:
HCOPYCNNZOWMTD-UHFFFAOYSA-M
SMILES:
[O-]S(=O)(=O)c1ccc2c3c1ccc1c3c(cc2)ccc1.[Na+]
EC Number:
261-698-2
Properties
Complexity:
486  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.017g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
304.295g/mol
Monoisotopic Mass:
304.017g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
65.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties