Completing data — usually done within a minute
Basic information
- CAS
4274-41-3- Standard SMILES
COc1ccc(S)c(N)c1.Cl- InChIKey
WNHFUHQVIHNIMN-UHFFFAOYSA-N- Molecular formula
- C7H10ClNOS
- Average molar mass
- 191.68 g/mol
- Monoisotopic mass
- 191.0171628
Names & identifiers
- Preferred name
- 2-Amino-4-methoxybenzene-1-thiol hydrochloride
- IUPAC
- 2-amino-4-methoxybenzenethiol;hydrochloride
Names & synonyms
2-Amino-4-methoxybenzene-1-thiol hydrochloride4274-41-3RefChem:464317828-225-72-amino-4-methoxybenzenethiol;hydrochloride2-amino-4-methoxybenzenethiol hydrochlorideSCHEMBL247330WNHFUHQVIHNIMN-UHFFFAOYSA-NAT196472-AMINO-4-METHOXYBENZENETHIOL HCL2-amino-4-methoxythiophenol hydrochloride2-Amino-4-methoxybenzene-1-thiolhydrochloride
Show more names
EN300-3449972-Amino-4-methoxybenzenethiol Hydrochloride; 2-Amino-4-methoxybenzene-1-thiol hydrochloride; Benzenethiol, 2-amino-4-methoxy-, hydrochloride
Database identifiers
- CAS
4274-41-3- PubChem CID
- 12199296
- EC Number
- 828-225-7
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 36.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 110
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)
Chemistry & industry
Suppliers2 total
无锡丽恒昇生物医药科技有限公司15250805028 15250805028 · [email protected]
烟台盛凯伦化学科技有限公司13356901049 · [email protected]
Related reactions
2 records
Compound notes
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