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

Benzenethiol, 2-amino-, hydrochloride (1:1)

HCID 76794
New noteNew reactionRequest quotes
Print preview

Completing data — refresh the page later to see the latest

Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
3292-42-0
Standard SMILES
Cl.Nc1ccccc1S
InChIKey
PEDOSWZBWWCOAY-UHFFFAOYSA-N
Molecular formula
C6H8ClNS
Average molar mass
161.65 g/mol
Monoisotopic mass
161.00659794

Names & identifiers

Preferred name
Benzenethiol, 2-amino-, hydrochloride (1:1)
IUPAC
2-aminobenzenethiol;hydrochloride
English name
2-Aminobenzenthiol hydrogen chloride, 97%
Molecular formula
C6H8ClNS
Molecular weight
161.65

Names & synonyms

3292-42-02-Aminothiophenol hydrochlorideBenzenethiol, 2-amino-, hydrochloride (1:1)DTXSID40186574RefChem:916897DTXCID80109065o-Aminothiophenol hydrochloride2-Aminobenzenethiol hydrochlorideUSAF XR-172-Aminothiophenol HClBenzenethiol, 2-amino-,hydrochlorideSCHEMBL442526
Show more names
2-Aminobenzenthiol hydrogen chloride, 97%2-Aminobenzenthiol hydrogen chloride, 97%
2-aminobenzenethiol;hydrochloridePEDOSWZBWWCOAY-UHFFFAOYSA-N2-Aminobenzene-1-thiol--hydrogen chloride (1/1)

Database identifiers

CAS
3292-42-0
PubChem CID
76794
DTXSID
DTXSID40186574

Properties

Computed structural propertiesFilling in

Topological polar surface area
27 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
2
Rotatable bonds
0
Heavy atoms
9
Formal charge
0
Complexity
74.9

Physicochemical properties

Melting point
217 °C · 217 °C
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

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
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Upstream & downstream products

Downstream products

2,2'-Methylenebisbenzothiazole

Related reactions

2 records
New reaction record
HRID 1655894 reaction equation
HRID 1655894As reactantuspto-grants-1993_10
HRID 2419527 reaction equation
HRID 2419527As reactantuspto-grants-1978_08

Compound notes

Loading…

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