Basic information
- CAS
152815-18-4- Standard SMILES
Cc1cc(CO)cc(Cl)n1- InChIKey
YXPVCSWOMRFRCS-UHFFFAOYSA-N- Molecular formula
- C7H8ClNO
- Average molar mass
- 157.6 g/mol
- Monoisotopic mass
- 157.0294416
Names & identifiers
- Preferred name
- (2-Chloro-6-methylpyridin-4-yl)methanol
- IUPAC
- (2-chloro-6-methyl-4-pyridinyl)methanol
- English name
- (2-chloro-6-methylpyridin-4-yl)methanol
- Molecular formula
- C7H8ClNO
- Molecular weight
- 157.6
Names & synonyms
(2-chloro-6-methylpyridin-4-yl)methanol152815-18-4RefChem:395643961-776-2MFCD16607334(2-Chloro-6-methyl-4-pyridyl)methanol(2-chloro-6-methyl-pyridin-4-yl)-methanolSCHEMBL501235SCHEMBL5898063YXPVCSWOMRFRCS-UHFFFAOYSA-NSB534442-chloro4-hydroxymethyl-6-methylpyridine
Show more names
4-Pyridinemethanol, 2-chloro-6-methyl-
DA-09949SY269196WS-02020(2-chloro-6-methylpyridin-4-yl)-methanol2-chloro-4-hydroxymethyl-6-methylpyridineCS-0214821EN300-1965678F539447
Database identifiers
- CAS
152815-18-4- PubChem CID
- 22504306
- EC Number
- 961-776-2
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 33.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 110
Physicochemical properties
- Boiling point
- 280.9 · 280.9±35.0 °C(Predicted)
- Density
- 1.263 · 1.263±0.06 g/cm3(Predicted)
- form
- solid
- pka
- 13.1 · 13.10±0.10(Predicted)
- InChI
- 1S/C7H8ClNO/c1-5-2-6(4-10)3-7(8)9-5/h2-3,10H,4H2,1H3
- InChIKey
- YXPVCSWOMRFRCS-UHFFFAOYSA-N
- SMILES
- ClC1=NC(C)=CC(CO)=C1
- UNSPSC Code
- 12352200 · 12352200
- NACRES
- 21 · NA.21
- Symbol(GHS)
- 5 · GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 302 · H302-H318
- Precautionary statements
- 280 · P280-P301+P312+P330-P305+P351+P338+P310
- WGK Germany
- 3 · WGK 3
- Storage Class
- 11 · 11 - Combustible Solids
- Hazard Classifications
- 4 OralEye · Acute Tox. 4 OralEye Dam. 1
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H226 (50%): Flammable liquid and vapor [Warning Flammable liquids]；H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (50%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (50%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 3 (50%)；Acute Tox. 4 (50%)；Skin Irrit. 2 (50%)；Eye Dam. 1 (50%)；Eye Irrit. 2A (50%)；STOT SE 3 (50%)
Safety data
- wgk
- WGK 3
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07
- Storage Class
- 11 - Combustible Solids
- Hazard statements
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers11 total
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
苏州施亚生物科技有限公司0512-0512-52358471 17715136450 · [email protected]
上海麦克林生化科技股份有限公司50706066 15221275939 · [email protected]
四川铂友生物科技有限公司（原四川佰朋）028-65791793 18140026355 · [email protected]
西安速加医药科技有限公司029-86115547 17791676824 · [email protected]
西安拓超生物科技有限公司02988764766 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 17714375163 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
Cochemical Co. Ltd.+86-029-86115547 +86-17791676824 · [email protected]
苏州明石新科生物科技有限公司13914069417 · [email protected]
珠海奥博凯生物医药技术有限公司
Related reactions
30 records
Compound notes
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