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

(4-Nitrophenyl)ethanimidamide--hydrogen chloride (1/1)

HCID 38314
New noteNew reactionRequest quotes
Print preview
Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
39695-96-0
Standard SMILES
NC(=[NH2+])Cc1ccc([N+](=O)[O-])cc1.[Cl-]
InChIKey
UWOXNCVLVJFRHA-UHFFFAOYSA-N
Molecular formula
C8H10ClN3O2
Average molar mass
215.64 g/mol
Monoisotopic mass
215.0461543

Names & identifiers

Preferred name
(4-Nitrophenyl)ethanimidamide--hydrogen chloride (1/1)
IUPAC
[1-amino-2-(4-nitrophenyl)ethylidene]azanium chloride
English name
2-(4-Nitrophenyl)ethanimidamide hydrochloride
Molecular formula
C8H10ClN3O2
Molecular weight
215.6369

Names & synonyms

DTXSID90960301(4-Nitrophenyl)ethanimidamide--hydrogen chloride (1/1)RefChem:1050443DTXCID10138816139695-96-0p-Nitrophenylacetamidine hydrochloride[1-amino-2-(4-nitrophenyl)ethylidene]azanium;chloride4-Nitrobenzeneethanimidamide monohydrochlorideBenzeneethanimidamide, 4-nitro-, monohydrochlorideACETAMIDINE, 2-(p-NITROPHENYL)-, HYDROCHLORIDE2-(4-Nitrophenyl)ethanimidamide hydrochloride

Database identifiers

CAS
39695-96-0
PubChem CID
38314

Properties

Computed structural properties

Topological polar surface area
97.4 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
14
Formal charge
0
Complexity
198

Physicochemical properties

Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319
Precautionary statements
264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313

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

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H315-H319
Precautionary statements
P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

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