AC1MID68
7-[[2-(carbamoylamino)-4-(2,3-dibromopropanoylamino)phenyl]diazenyl]naphthalene-1,3-disulfonic acid
Also Known As: EINECS 298-416-2|7-((2-((Aminocarbonyl)amino)-4-((2,3-dibromo-1-oxopropyl)amino)phenyl)azo)naphthalene-1,3-disulphonic acid|7-[[2-(carbamoylamino)-4-(2,3-dibromopropanoylamino)phenyl]diazenyl]naphthalene-1,3-disulfonic acid|7-[[2-[(AMINOCARBONYL)AMINO]-4-[(2,3-DIBROMO-1-OXOPROPYL)AMINO]PHENYL]AZO]NAPHTHALENE-1,3-DISULFONIC ACID|7-[[2-[(Aminocarbonyl)amino]-4-[(2,3-dibromo-1-oxopropyl)amino]phenyl]azo]1,3-naphthalenedisulfonic acid|7-[[2-[(aminocarbonyl)amino]-4-[(2,3-dibromo-1-oxopropyl)amino]phenyl]azo]naphthalene-1,3-disulphonic acid|7-[2-[2-[(Aminocarbonyl)amino]-4-[(2,3-dibromo-1-oxopropyl)amino]phenyl]diazenyl]-1,3-naphthalenedisulfonic acid|7-{2-[2-(CARBAMOYLAMINO)-4-(2,3-DIBROMOPROPANAMIDO)PHENYL]DIAZEN-1-YL}NAPHTHALENE-1,3-DISULFONIC ACID
| Molecular Formula | C20H17Br2N5O8S2 |
|---|---|
| Molecular Weight | 676.88855 g/mol |
| LogP | 4.3361 |
| Topological Polar Surface Area | 217.68 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 676.88855 |
| Monoisotopic Mass | 678.8865 |
| Heavy Atoms | 37 |
| Complexity | 1645.9281 |
Chemical Identifiers
| CAS Number | 93804-41-2 |
|---|---|
| SMILES | C1=CC(=CC2=C(C=C(C=C21)S(=O)(=O)O)S(=O)(=O)O)N=NC3=C(C=C(C=C3)NC(=O)C(CBr)Br)NC(=O)N |
Product Overview
AC1MID68 (CAS 93804-41-2), with molecular formula C20H17Br2N5O8S2 and molecular weight 676.88855 g/mol. IUPAC: 7-[[2-(carbamoylamino)-4-(2,3-dibromopropanoylamino)phenyl]diazenyl]naphthalene-1,3-disulfonic acid.