Basic information
- CAS
62658-90-6- Standard SMILES
CSc1ncccc1CO- InChIKey
UTKCWZWWIQFORB-UHFFFAOYSA-N- Molecular formula
- C7H9NOS
- Average molar mass
- 155.22 g/mol
- Monoisotopic mass
- 155.04048491
Names & identifiers
- Preferred name
- [2-(Methylsulfanyl)pyridin-3-yl]methanol
- IUPAC
- (2-methylsulfanyl-3-pyridinyl)methanol
- English name
- (2-(METHYLTHIO)PYRIDIN-3-YL)METHANOL
- Molecular formula
- C7H9NOS
- Molecular weight
- 155.22
Names & synonyms
62658-90-6[2-(METHYLSULFANYL)PYRIDIN-3-YL]METHANOLDTXSID40621576(2-(Methylsulfanyl)pyridin-3-yl)methanolRefChem:205687DTXCID20572330836-643-63-Hydroxymethyl-2-methylthiopyridine(2-(METHYLTHIO)PYRIDIN-3-YL)METHANOL(2-methylsulfanylpyridin-3-yl)methanolSCHEMBL4065887UTKCWZWWIQFORB-UHFFFAOYSA-N
Show more names
3-Pyridinemethanol, 2-(methylthio)-
MCA65890AKOS006330046MB07043(2-methylsulfanyl-pyridin-3-yl)-methanolDB-344521EN300-3471806Z1198184816
Database identifiers
- CAS
62658-90-6- PubChem CID
- 22018843
- DTXSID
DTXSID40621576- EC Number
- 836-643-6
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 58.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 99.6
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H335-H319-H302
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
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%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H335-H319-H302
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers4 total
安徽合诺生物科技有限公司0555-2761852
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
南京凯姆铂医药科技有限公司025-66162170
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
2 records
Compound notes
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