Basic information
- CAS
7675-47-0- Standard SMILES
C1CCC(NC2CCCCC2)CC1.O=C(O)CNSc1ccccc1[N+](=O)[O-]- InChIKey
QHKBANTYLBSWKY-UHFFFAOYSA-N- Molecular formula
- C20H31N3O4S
- Average molar mass
- 409.5 g/mol
- Monoisotopic mass
- 409.20352765
Names & identifiers
- Preferred name
- Einecs 231-651-0
- IUPAC
- N-cyclohexylcyclohexanamine;2-[(2-nitrophenyl)sulfanylamino]acetic acid
- English name
- N-o-Nitrophenylsulfenyl-glycine di(cyclohexyl)ammonium salt
- Molecular formula
- C20H31N3O4S
- Molecular weight
- 409.55
Names & synonyms
7675-47-0EINECS 231-651-0N-((2-Nitrophenyl)thio)glycine, compound with N-dicyclohexylamine (1:1)Dicyclohexylamine ((2-nitrophenyl)thio)glycinateN-(2-Nitrophenylsulfenyl)glycine (dicyclohexylamine)SCHEMBL2900787SCHEMBL2900788DTXSID90227567HY-W141920DB-056121CS-0201711N-(2-Nitrophenylsulfenyl)glycine (dicyclohexylammonium) salt, powder
Show more names
N-O-nitrophenylsulfenyl-glycine dchaO-NPS-GLYCINE DICYCLOHEXYLAMINE SALTN-(2-NITROPHENYLSULFENYL)-L-ALANINE (DICYCLOHEXYLAMMONIUM)N-o-Nitrophenylsulfenyl-glycine di(cyclohexyl)ammonium saltn-(2-nitrophenylsulfenyl)glycine (dicyclohexylammonium) saltN-(2-Nitrophenylsulfenyl)glycine (dicyclohexylaMMoniuM) salt powderN-[(2-nitrophenyl)thio]glycine, compound with N-dicyclohexylamine (1:1)N-o-NPS-Glycine, dicyclohexylammonium salt N-o-Nitrophenylsulfenyl-glycine, dicyclohexylammonium salt
N-[(2-Nitrophenyl)sulfanyl]glycine--N-cyclohexylcyclohexanamine (1/1)N-cyclohexylcyclohexanamine;2-[(2-nitrophenyl)sulfanylamino]acetic acid
Properties
Computed structural properties
- Topological polar surface area
- 132 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 359
Physicochemical properties
- storage temp.
- 20 °C · −20°C
- form
- powder
- color
- yellow
- WGK Germany
- 3 · 3
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
Chemistry & industry
Suppliers5 total
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
斯百全化学（上海）有限公司021-021-021-67601398-809-809-809 15221380277 · [email protected]
广州爱纯医药科技有限公司020-39119399 18927568969 · [email protected]
江苏洪珉药业有限公司18221292452 · [email protected]
湖北玖天生物医药科技有限公司027-88013699 17354350817 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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