HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

ANILINE, N-ETHYL-p-((p-NITROPHENYL)THIO)-

HCID 22026
New noteNew reactionRequest quotes
Print preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
5786-51-6
Standard SMILES
CCNc1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1
InChIKey
RPGPTHLUEOMMRN-UHFFFAOYSA-N
Molecular formula
C14H14N2O2S
Average molar mass
274.34 g/mol
Monoisotopic mass
274.07759887

Names & identifiers

Preferred name
ANILINE, N-ETHYL-p-((p-NITROPHENYL)THIO)-
IUPAC
N-ethyl-4-(4-nitrophenyl)sulfanylaniline

Names & synonyms

5786-51-6ANILINE, N-ETHYL-p-((p-NITROPHENYL)THIO)-Benzenamine, N-ethyl-4-((4-nitrophenyl)thio)-W3L4ET8V42N-ethyl-4-(4-nitrophenyl)sulfanylanilineBRN 3349140p-Nitro-p'-ethylaminodiphenylsulfidep-Nitro-p'-ethylaminodiphenylsulphideN-Ethyl-p-((p-nitrophenyl)thio)anilineUNII-W3L4ET8V42N-ETHYL-4-[(4-NITROPHENYL)SULFANYL]ANILINEDTXSID10206571
Show more names
N-ETHYL-4-((4-NITROPHENYL)THIO)BENZENAMINE

Database identifiers

CAS
5786-51-6
PubChem CID
22026
DTXSID
DTXSID10206571
UNII
W3L4ET8V42
Nikkaji
J60.424K

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
83.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
19
Formal charge
0
Complexity
280

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes