Basic information
- CAS
73278-91-8- Standard SMILES
OCc1cccc(CN2CCCCC2)c1- InChIKey
NZKXLHGCZWDXGE-UHFFFAOYSA-N- Molecular formula
- C13H19NO
- Average molar mass
- 205.3 g/mol
- Monoisotopic mass
- 205.14666423
Names & identifiers
- Preferred name
- (3-((Piperidin-1-yl)methyl)phenyl)methanol
- IUPAC
- [3-(piperidin-1-ylmethyl)phenyl]methanol
- English name
- [3-(Piperidinomethyl)phenyl]methanol
- Molecular formula
- C13H19NO
- Molecular weight
- 205.3
Names & synonyms
{3-[(piperidin-1-yl)methyl]phenyl}methanol3-(1-Piperidinylmethyl)benzenemethanol(3-((Piperidin-1-yl)methyl)phenyl)methanolRefChem:399460993-180-373278-91-8[3-(Piperidinomethyl)phenyl]methanol(3-(Piperidin-1-ylmethyl)phenyl)methanol[3-(piperidin-1-ylmethyl)phenyl]methanolMFCD07772858[3-(1-piperidylmethyl)phenyl]methanol3-piperidinomethylbenzylalcohol
Show more names
[3-(Piperidinomethyl)phenyl]methanol 90%Benzenemethanol, 3-(1-piperidinylmethyl)-
SCHEMBL3742515DTXSID50428215NZKXLHGCZWDXGE-UHFFFAOYSA-NYCA27891SBB0935163-(1-piperidylmethyl)-benzyl alcoholAKOS000320974[3-(piperidylmethyl)phenyl]methan-1-ol
Database identifiers
- CAS
73278-91-8- PubChem CID
- 7164645
- DTXSID
DTXSID50428215- EC Number
- 993-180-3
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 177
Physicochemical properties
- Melting point
- 67 °C · 67 °C
- Boiling point
- 324.3 · 324.3±22.0 °C(Predicted)
- Density
- 1.082 · 1.082±0.06 g/cm3(Predicted)
- pka
- 14.36 · 14.36±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
GHS classification
GHS Classification
Danger
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+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 CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers4 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
赛默飞世尔科技（中国）有限公司800-810-5118 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
13 records
Compound notes
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