RefChem:564330 structure

RefChem:564330

calcium bis(3-chloro-5-[(2-hydroxynaphthalen-1-yl)diazenyl]-4-methylbenzenesulfonate)

Also Known As: EINECS 269-182-9|C17H13ClN2O4S.1/2Ca|C17-H13-Cl-N2-O4-S.1/2Ca|calciumbis[2-chloro-6-[ azo]toluene-4-sulphonate]|5-Chloro-3-((2-hydroxy-1-naphthalenyl)azo)-4-methylbenzenesulfonic acid, calcium salt (2:1)|Benzenesulfonic acid, 3-chloro-5-[(2-hydroxy-1-naphthalenyl)azo]-4-methyl-, calcium salt (2:1)|Benzenesulfonic acid, 3-chloro-5-((2-hydroxy-1-naphthalenyl)azo)-4-methyl-, calcium salt (2:1)|Benzenesulfonic acid, 3-chloro-5-(2-(2-hydroxy-1-naphthalenyl)diazenyl)-4-methyl-, calcium salt (2:1)|Calcium 3-chloro-5-((2-hydroxynaphthalen-1-yl)diazenyl)-4-methylbenzenesulfonate|CALCIUM BIS(2-CHLORO-6-((2-HYDROXY-NAPHTHALEN-1-YL)AZO)TOLUENE-4-SULFONATE)|Calcium bis(2-chloro-6-((2-hydroxy-1-naphthyl)azo)toluene-4-sulphonate)|Calcium bis[2-chloro-6-[(2-hydroxy-1-naphthyl)azo]toluene-4-sulphonate]|Calcium bis{3-chloro-5-[(2-hydroxynaphthalen-1-yl)diazenyl]-4-methylbenzene-1-sulfonate}|Benzenesulfonic acid, 3-chloro-5-[2-(2-hydroxy-1-naphthalenyl)diazenyl]-4-methyl-, calcium salt (2:1)

CAS: 68189-24-2
Molecular Formula C34H24CaCl2N4O8S2
Molecular Weight 790.00385 g/mol
LogP 9.27
Topological Polar Surface Area 204.3 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 12
Rotatable Bonds 6
Exact Mass 790.00385
Heavy Atoms 51
Complexity 2408.0

Chemical Identifiers

CAS Number 68189-24-2
SMILES CC1=C(C=C(C=C1Cl)S(=O)(=O)[O-])N=NC2=C(C=CC3=CC=CC=C32)O.CC1=C(C=C(C=C1Cl)S(=O)(=O)[O-])N=NC2=C(C=CC3=CC=CC=C32)O.[Ca+2]

Product Overview

RefChem:564330 (CAS 68189-24-2), with molecular formula C34H24CaCl2N4O8S2 and molecular weight 790.00385 g/mol. IUPAC: calcium bis(3-chloro-5-[(2-hydroxynaphthalen-1-yl)diazenyl]-4-methylbenzenesulfonate).

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