Basic information
- CAS
15031-78-4- Standard SMILES
CC(C)(O)c1ccncc1- InChIKey
WEQVCDIJDUVSID-UHFFFAOYSA-N- Molecular formula
- C8H11NO
- Average molar mass
- 137.18 g/mol
- Monoisotopic mass
- 137.08406397
Names & identifiers
- Preferred name
- 2-(4-Pyridyl)-2-propanol
- IUPAC
- 2-pyridin-4-ylpropan-2-ol
- English name
- 2-(4-PYRIDYL)-2-PROPANOL
- Molecular formula
- C8H11NO
- Molecular weight
- 137.18
Names & synonyms
2-(4-Pyridyl)-2-propanol15031-78-4DTXSID00404483RefChem:458315DTXCID70355337678-444-52-(Pyridin-4-yl)propan-2-ol1-Methyl-1-(4-pyridyl)ethanol2-pyridin-4-ylpropan-2-olMFCD000717464-Pyridinemethanol, alpha,alpha-dimethyl-2-(4-pyridyl)propan-2-ol
Show more names
2-pyridin-4-yl-2-propanol2-(4-Pyridyl)-2-propanol>1-METHYL-1-(4-PYRIDYL)ETHANOL4-Pyridinemethanol, a,a-dimethyl-4-Pyridinemethanol, α,α-dimethyl-
2-(4-Pyridyl)isopropyl Alcohol4-PyridyldimethylcarbinolDimethyl-4-pyridylcarbinolSCHEMBL2554687SCHEMBL3332843a,a-Dimethyl-4-pyridinemethanolSCHEMBL15229369SCHEMBL27083514
Database identifiers
- CAS
15031-78-4- PubChem CID
- 4580583
- DTXSID
DTXSID00404483- EC Number
- 678-444-5
- Nikkaji
- J2.643.588I
Properties
Computed structural properties
- XLogP
- 0.6
- 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
- 106
Physicochemical properties
- Melting point
- 136 °C · 136 °C
- Boiling point
- 140 °C · 140 °C / 3mmHg
- Density
- 1.052 · 1.052±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- soluble in Methanol
- form
- powder to crystal
- pka
- 13.58 · 13.58±0.29(Predicted)
- color
- White to Light yellow to Light orange
- CAS DataBase Reference
- 15031 · 15031-78-4
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
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
Warning
H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (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.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (50%)
Safety data
- hs_code
- 2933399990
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- hazard_class
- IRRITANT
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Chemistry & industry
Suppliers70 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
湖北云镁科技有限公司027-59206672 18327059871 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
广东百科试剂有限公司13532366769 13686183698 · [email protected]
苏州维塔力生物医药有限公司512-68242903 13916956214 · [email protected]
韶远科技（上海）有限公司4000665055 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13318593351 · [email protected]
常州科化生物科技有限公司
Related reactions
2 records
Compound notes
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