Cas no 3071-71-4 (Direct Black 103)
Direct Black 103 structure
Product Name:Direct Black 103
CAS No:3071-71-4
MF:C40H23N7Na4O13S4
MW:1029.86880707741
CID:321170
Update Time:2023-11-19
Direct Black 103 Chemical and Physical Properties
Names and Identifiers
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- 1,5-Naphthalenedisulfonicacid,3-[2-[4-[2-[4-[2-(7-amino-1-hydroxy-3-sulfo-2-naphthalenyl)diazenyl]-6-sulfo-1-naphthalenyl]diazenyl]-1-naphthalenyl]diazenyl]-,sodium salt (1:4)
- 1,5-Naphthalenedisulfonicacid,3-[2-[4-[2-[4-[2-(7-amino-1-hydroxy-3-sulfo-2-naphthalenyl)diazenyl]-6-sulfo-1-naphthalenyl]dia
- Direct Fast Grey 2BL
- Diazol Light Grey 4B
- direct black 103
- C.I.34179
- CID 101690392
- C.I.Direct Black 103
- 3-[[4-[[4-[(7-Amino-1-hydroxy-3-sodiosulfo-2-naphthalenyl)azo]-6-sodiosulfo-1-naphthalenyl]azo]-1-naphthalenyl]azo]naphthalene-1,5-disulfonic acid disodium salt
- 1, 5-Naphthalenedisulfonic acid, 3-[[4-[[4-[(7-amino-1-hydroxy-3-sulfo-2-naphthalenyl)-azo]-6-sulfo-1-naphthalenyl]azo]-1-naphthalenyl]azo], tetrasodium salt
- Direct Fast Black 2B
- Direct Fast Grey L
- Direct Grey Light Fast
- Direct Black 103
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- Inchi: 1S/C40H27N7O13S4.4Na/c41-22-9-8-21-16-38(64(58,59)60)39(40(48)29(21)17-22)47-46-35-15-14-34(27-11-10-24(20-30(27)35)61(49,50)51)45-44-33-13-12-32(25-4-1-2-5-26(25)33)43-42-23-18-31-28(37(19-23)63(55,56)57)6-3-7-36(31)62(52,53)54;;;;/h1-20,48H,41H2,(H,49,50,51)(H,52,53,54)(H,55,56,57)(H,58,59,60);;;;/q;4*+1/p-4/b43-42+,45-44+,47-46+;;;;
- InChI Key: HLEDAFCMZNLLFP-PSDAWCJYSA-J
- SMILES: S(C1C=C(C=C2C(=CC=CC2=1)S(=O)(=O)[O-])/N=N/C1=CC=C(C2C=CC=CC=21)/N=N/C1=CC=C(C2=CC(=CC=C21)S(=O)(=O)[O-])/N=N/C1C(=C2C=C(C=CC2=CC=1S(=O)(=O)O)N)[O-])(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]
Computed Properties
- Exact Mass: 1028.983
- Monoisotopic Mass: 1028.983
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 20
- Heavy Atom Count: 68
- Rotatable Bond Count: 7
- Complexity: 2170
- Covalently-Bonded Unit Count: 5
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 383
Direct Black 103 Related Literature
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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4. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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