CAS
93804-41-2 Purity
96%
93804-41-2 Purity
96%
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Disodium 7-[[2-[(aminocarbonyl)amino]-4-[(2-bromo-1-oxoallyl)amino]phenyl]azo]naphthalene-1,3-disulfonate
CAS
93804-44-5
Catalog Number
ACM93804445
Category
Other Products
Molecular Weight
642.367400 [g/mol]
Molecular Formula
C20H14BrN5Na2O8S2
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Specification
Synonyms
EINECS 298-419-9, CID11971137, 93804-44-5, Disodium 7-((2-((aminocarbonyl)amino)-4-((2-bromo-1-oxoallyl)amino)phenyl)azo)naphthalene-1,3-disulphonate
IUPAC Name
disodium 7-[[4-(2-bromoprop-2-enoylamino)-2-(carbamoylamino)phenyl]diazenyl]naphthalene-1,3-disulfonate
Canonical SMILES
C=C(C(=O)NC1=CC(=C(C=C1)N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)N)Br.[Na+].[Na+]
InChI Key
MAJZSBCHNJHCQS-UHFFFAOYSA-L
EC Number
298-419-9
Exact Mass
640.92600
H-Bond Acceptor
10
H-Bond Donor
3
What is the molecular formula of Disodium 7-[[2-[(aminocarbonyl)amino]-4-[(2-bromo-1-oxoallyl)amino]phenyl]azo]naphthalene-1,3-disulfonate?
The molecular formula is C20H14BrN5Na2O8S2.
When was Disodium 7-[[2-[(aminocarbonyl)amino]-4-[(2-bromo-1-oxoallyl)amino]phenyl]azo]naphthalene-1,3-disulfonate created?
It was created on December 27, 2006.
What is the IUPAC name of Disodium 7-[[2-[(aminocarbonyl)amino]-4-[(2-bromo-1-oxoallyl)amino]phenyl]azo]naphthalene-1,3-disulfonate?
The IUPAC name is disodium;7-[[4-(2-bromoprop-2-enoylamino)-2-(carbamoylamino)phenyl]diazenyl]naphthalene-1,3-disulfonate.
What is the InChIKey of Disodium 7-[[2-[(aminocarbonyl)amino]-4-[(2-bromo-1-oxoallyl)amino]phenyl]azo]naphthalene-1,3-disulfonate?
The InChIKey is MAJZSBCHNJHCQS-UHFFFAOYSA-L.
How many hydrogen bond donor counts are there in Disodium 7-[[2-[(aminocarbonyl)amino]-4-[(2-bromo-1-oxoallyl)amino]phenyl]azo]naphthalene-1,3-disulfonate?
There are 3 hydrogen bond donor counts.
What is the topological polar surface area of Disodium 7-[[2-[(aminocarbonyl)amino]-4-[(2-bromo-1-oxoallyl)amino]phenyl]azo]naphthalene-1,3-disulfonate?
The topological polar surface area is 240 Ų.
How many covalently-bonded unit counts are there in Disodium 7-[[2-[(aminocarbonyl)amino]-4-[(2-bromo-1-oxoallyl)amino]phenyl]azo]naphthalene-1,3-disulfonate?
There are 3 covalently-bonded unit counts.
What is the molecular weight of Disodium 7-[[2-[(aminocarbonyl)amino]-4-[(2-bromo-1-oxoallyl)amino]phenyl]azo]naphthalene-1,3-disulfonate?
The molecular weight is 642.4 g/mol.
Is the compound canonicalized?
Yes, the compound is canonicalized.
What are the synonyms for Disodium 7-[[2-[(aminocarbonyl)amino]-4-[(2-bromo-1-oxoallyl)amino]phenyl]azo]naphthalene-1,3-disulfonate?
The synonyms are EINECS 298-419-9 and 93804-44-5 Disodium 7-((2-((aminocarbonyl)amino)-4-((2-bromo-1-oxoallyl)amino)phenyl)azo)naphthalene-1,3-disulphonate.
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