Tetrahydropyran-2-methanol

HCID 7524CAS 100-72-1
Substructure searchFind similar structures

Basic information

Standard SMILES
OCC1CCCCO1
InChIKey
ROTONRWJLXYJBD-UHFFFAOYSA-N
Molecular formula
C6H12O2
Average molar mass
116.16 g/mol
Monoisotopic mass
116.08372962

Overview

2-Methanol tetrahydropyran is a member of oxanes.

Names & identifiers

Preferred name
Tetrahydropyran-2-methanol
IUPAC
oxan-2-ylmethanol
English name
TETRAHYDROPYRAN-2-METHANOL
Molecular formula
C6H12O2
Molecular weight
116.16

Names & synonyms

TETRAHYDROPYRAN-2-METHANOL100-72-12-Hydroxymethyltetrahydropyran2H-Pyran-2-methanol, tetrahydro-Tetrahydropyran-2-carbinolPyran-2-methanol, tetrahydro-2-(Hydroxymethyl)tetrahydropyran2-Methanol tetrahydropyran2-TetrahydropyranilcarbinolTetrahydropyran-2-ylmethanolTetrahydropyranyl-2-methanol2-Methyloltetrahydro-1,4-pyran
Show more names
(TETRAHYDRO-2H-PYRAN-2-YL)METHANOLWLN: T6OTJ B1QUNII:JR71SUM5E9TIMTEC-BB SBB008943[(2R)-2-oxanyl]methanolOXACYCLOHEXYL-2-METHANOL2-methanoltetrahydropyranetrahydropyran-2-methanoltetrahydro-pyran-2-methano
NSC 5221Tetrahydro-2H-pyran-2-methanolJR71SUM5E9EINECS 202-882-4BRN 0102998AI3-14307NSC-52215-17-03-00136 (Beilstein Handbook Reference)

Database identifiers

CAS
100-72-1
PubChem CID
7524
DTXSID
DTXSID40870441
ChEBI
CHEBI:228990
UNII
JR71SUM5E9
EC Number
202-882-4
Nikkaji
J35.394I

Properties

Computed structural properties

XLogP
0.3
Topological polar surface area
29.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
8

Experimental & physicochemical properties

PolymersOther Classes -> Alcohols and Polyols, Other
Vapor Pressure0.1 [mmHg]
Physical DescriptionColorless liquid; [Alfa Aesar MSDS]

Physicochemical properties

Melting point
187 °C · 187°C
Boiling point
187 °C · 187 °C (lit.)
Density
1.027 g/mL · 1.027 g/mL at 25 °C (lit.)
vapor density
4.02 · 4.02 (vs air)
vapor pressure
0.4 mm · 0.4 mm Hg ( 20 °C)
refractive index
20 · n20/D 1.458(lit.)

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 47 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory Information2H-Pyran-2-methanol, tetrahydro-: Does not have an individual approval but may be used under an appropriate group standard
Hazards SummaryA mild-to-severe skin and severe eye irritant; Dermal LD50 (rabbit) = 4 mL/kg; [RTECS] A skin and strong eye irritant; [Alfa Aesar MSDS] See Tetrahydropyran.
Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

PPE
Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
wgk
2
rtecs
UQ0175000
hs_code
29329990
risk_code
36/38
Signal word
Warning

Chemistry & industry

Applications

UsesChemical intermediate.

Upstream & downstream products

Suppliers50 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]

Related reactions

62 records
New reaction record

Linked notes

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