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3811-71-0

Basic Information
CAS No.: 3811-71-0
Name: DIANIL BROWN 3GN
Molecular Structure:
Molecular Structure of 3811-71-0 (DIANIL BROWN 3GN)
Formula: C31H22N8Na2O6S
Molecular Weight: 680.6009
Synonyms: Benzoicacid,5-[[4'-[[2,4-diamino-5-[(4-sulfophenyl)azo]phenyl]azo][1,1'-biphenyl]-4-yl]azo]-2-hydroxy-,disodium salt (9CI);C.I. Direct Brown 1, disodium salt (8CI);Salicylic acid,5-[[4'-[[2,4-diamino-5-[(p-sulfophenyl)azo]phenyl]azo]-4-biphenylyl]azo]-, disodiumsalt (7CI);Airedale Brown GWD;Amanil Brown D 3G;Atlantic Brown 3GN;AzineBrown 2RG;Azine Brown 3G;Azocard Brown 3G;Azocard Brown 3GR;Azocard Brown5G;Bencidal Brown 3G;Benzanil Brown GW;Benzanol Brown CG;Benzo Orange BrownD 3G;Brasilamina Brown GN;C.I. Direct Brown 1;Calcomine YellowBrown K;Chrome Leather Brown 5G;Cupranil Brown G;Diacotton Brown 3G;DiamineBrown 3GN;Diamine Brown 3GPA;Diaphtamine Brown 3G;Diphenyl Brown GR;Diphenyl Brown GRI;Diphenyl Brown MG;Direct Brown 1;Direct Brown 3GO;DirectBrown D 3G;Direct Brown G;Direct Brown JJ;Direct Brown M 2GS;Direct BrownZhKh;Direct Chrome Brown G;Dirochrome Brown G;Enianil Brown 3GO;Erie BrownCN;Fenamin Brown 3G;Havana EMB;Hispamin Brown CTN;Honey Yellow 3GN;KayakuDirect Brown 3G;Metadiazol Brown 2JO;Metadiazol Brown 3JO;Mitsui DirectBrown 3G;Naphtamine Brown D 3G;Nippon Brown 3G;Paramine Brown G;Pheno Brown3GXX;Pheno Brown RP;Tertrodirect Brown G;Trisulfon Brown M;Trisulfon BrownTW;Trisulfon Brown TWP;Vondacel Brown G;
EINECS: 223-294-4
Density: 1.51g/cm3
Hazard Symbols: Xi,Xn
Risk Codes: R36/37/38; R22
PSA: 252.14000
LogP: 8.98060
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Chemistry

Molecular Structure of Benzoic acid,5-[2-[4'-[2-[2,4-diamino-5-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl][1,1'-biphenyl]-4-yl]diazenyl]-2-hydroxy-,sodium salt (1:2) (CAS NO.3811-71-0):

IUPAC Name: disodium 4-[4-[4-[2,4-diamino-5-(4-sulfonatophenyl)diazenylphenyl]diazenylphenyl]phenyl]diazenyl-
2-hydroxybenzoate 
Empirical Formula: C31H22N8Na2O6S
Molecular Weight: 680.6009
ACD/LogP: 7.91
of Rule of 5 Violations: 4
ACD/LogD (pH 5.5): 3.41
ACD/LogD (pH 7.4): 3.41
ACD/BCF (pH 5.5): 19
ACD/BCF (pH 7.4): 18.99
ACD/KOC (pH 5.5): 15.07
ACD/KOC (pH 7.4): 15.06
H bond acceptors: 14
H bond donors: 7
Freely Rotating Bonds: 12
EINECS: 223-294-4
Product Categories: Dyes and Pigments

Specification

  Benzoic acid,5-[2-[4'-[2-[2,4-diamino-5-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl][1,1'-biphenyl]-4-yl]diazenyl]-2-hydroxy-,sodium salt (1:2) , with CAS number of 3811-71-0, can be called Airedale Brown GWD ; Amanil Brown D3G ; Atlantic Brown 3GN ; Azine Brown 2RG ; Azine Brown 3G ; Azocard Brown 3G ; Azocard Brown 3GR .