1-Amino-4-[[4-[[3-[(2-chloroethyl)sulfonyl]benzoyl]methylamino]-2-sulfophenyl]amino]-9,10-dihydro-9,10-dioxo-2-anthracenesulfonic acid
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![1-Amino-4-[[4-[[3-[(2-chloroethyl)sulfonyl]benzoyl]methylamino]-2-sulfophenyl]amino]-9,10-dihydro-9,10-dioxo-2-anthracenesulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/f6e3d796e6da42e594327506efa289e7.png "1-Amino-4-[[4-[[3-[(2-chloroethyl)sulfonyl]benzoyl]methylamino]-2-sulfophenyl]amino]-9,10-dihydro-9,10-dioxo-2-anthracenesulfonic acid")
1-Amino-4-[[4-[[3-[(2-chloroethyl)sulfonyl]benzoyl]methylamino]-2-sulfophenyl]amino]-9,10-dihydro-9,10-dioxo-2-anthracenesulfonic acid
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CAS No:
52204-35-0
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Formula:
C30H24ClN3O11S3
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Chemical Name:
1-Amino-4-[[4-[[3-[(2-chloroethyl)sulfonyl]benzoyl]methylamino]-2-sulfophenyl]amino]-9,10-dihydro-9,10-dioxo-2-anthracenesulfonic acid
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Synonyms:
2-Anthracenesulfonic acid,1-amino-4-[[4-[[3-[(2-chloroethyl)sulfonyl]benzoyl]methylamino]-2-sulfophenyl]amino]-9,10-dihydro-9,10-dioxo-;1-Amino-4-[[4-[[3-[(2-chloroethyl)sulfonyl]benzoyl]methylamino]-2-sulfophenyl]amino]-9,10-dihydro-9,10-dioxo-2-anthracenesulfonic acid
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CAS No:
1-Amino-4-[[4-[[3-[(2-chloroethyl)sulfonyl]benzoyl]methylamino]-2-sulfophenyl]amino]-9,10-dihydro-9,10-dioxo-2-anthracenesulfonic acid Basic Attributes
734.2 g/mol
734.17
257-734-1
Computed Properties
Molecular Weight:734.2
XLogP3:3.2
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:13
Rotatable Bond Count:9
Exact Mass:733.0261498
Monoisotopic Mass:733.0261498
Topological Polar Surface Area:261
Heavy Atom Count:48
Complexity:1570
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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