Completing data — usually done within a minute
Basic information
- CAS
42961-88-6- Standard SMILES
Cc1cc(O)ccc1N.Cl- InChIKey
SVBTYYPNKULGBX-UHFFFAOYSA-N- Molecular formula
- C7H10ClNO
- Average molar mass
- 159.61 g/mol
- Monoisotopic mass
- 159.04509162
Names & identifiers
- Preferred name
- 4-Amino-M-cresol hydrochloride
- IUPAC
- 4-amino-3-methylphenol;hydrochloride
Names & synonyms
4-AMINO-M-CRESOL HYDROCHLORIDERefChem:518037623-332-34-amino-3-methylphenol hydrochloride42961-88-64-hydroxy-2-methylaniline hydrochlorideSCHEMBL4653710SCHEMBL298360284-Amino-m-cresol, hydrochlorideSVBTYYPNKULGBX-UHFFFAOYSA-NDTXSID8013379714-amino-m-cresol hydrogenchloride salt
Show more names
AKOS0243328934-Amino-3-methylphenol hydrochloride (1:1)
Database identifiers
- CAS
42961-88-6- PubChem CID
- 459234
- DTXSID
DTXSID801337971- EC Number
- 623-332-3
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 94.9
Safety & regulation
GHS classification
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Related reactions
25 records
Compound notes
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