Oxt-101

HCID 76444
NotesReactions
Substructure searchFind similar structures

Basic information

CAS
3047-32-3
Standard SMILES
CCC1(CO)COC1
InChIKey
UNMJLQGKEDTEKJ-UHFFFAOYSA-N
Molecular formula
C6H12O2
Average molar mass
116.16 g/mol
Monoisotopic mass
116.08372962

Names & identifiers

Preferred name
Oxt-101
IUPAC
(3-ethyloxetan-3-yl)methanol
English name
3-Ethyl-3-oxetanemethanol
Molecular formula
C6H12O2
Molecular weight
116.16

Names & synonyms

3-Ethyl-3-oxetanemethanol3047-32-33-Oxetanemethanol, 3-ethyl-3-Ethyloxetane-3-methanol3-ethyl-3-hydroxymethyloxetane3-Hydroxymethyl-3-ethyloxetaneOXT-1013-ethyl-3-(hydroxymethyl)oxetane622325VBYOOXA (OXETANE)EINECS 221-254-0DTXSID8062812
Show more names
(3-Ethyloxetan-3-yl)Methanol3-ethylEOXAEOXEHMOOXA (oxetYF-FM EHMOMonomer-EHMO
TRIMETHYLOLPROPANE OXETANEOXT 1013-ETHYL-3-METHYLOLOXETANEEC 221-254-03-ETHYL-3-OXETANYLMETHYL ALCOHOL3-ETHYL-3-(HYDROXYMETHYL)OXACYCLOBUTANERefChem:857812DTXCID5038204

Database identifiers

CAS
3047-32-3
PubChem CID
76444
DTXSID
DTXSID8062812
UNII
622325VBYO
EC Number
221-254-0
Nikkaji
J27.218C

Properties

Computed structural properties

XLogP
0.2
Topological polar surface area
29.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
8

Experimental & physicochemical properties

Physical DescriptionLiquid; CBI

Physicochemical properties

Boiling point
96 °C/4 · 96 °C/4 mmHg (lit.)
Density
1.019 g/mL · 1.019 g/mL at 25 °C (lit.)
vapor pressure
3.1 Pa · 3.1Pa at 25℃
refractive index
20 · n20/D 1.453(lit.)
Flash point
227 °F · 227 °F
storage temp.
2 · under inert gas (nitrogen or Argon) at 2-8°C

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H317 (54.1%): May cause an allergic skin reaction [Warning Sensitization, Skin]

P261, P264+P265, P272, P273, P280, P302+P352, P305+P351+P338, P321, P333+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 329 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory Information · 4 items

Chemical: 3-Oxetanemethanol, 3-ethyl-

3-Oxetanemethanol, 3-ethyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 3-Oxetanemethanol, 3-ethyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Status: Active Update: 18-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/11336

3-ethyl-3-hydroxymethyloxetane: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazard Classes and CategoriesSkin Sens. 1 (54.1%)

Safety data

PPE
Eyeshields, Gloves
wgk
3
tsca
TSCA listed
hs_code
29329990
risk_code
36/37/38-22
Signal word
Warning

Chemistry & industry

Uses & manufacturing

U.S. Production2023: 100,000 - <250,000 lb
Industry UsesDiluent
General Manufacturing Information · 2 items

All Other Chemical Product and Preparation Manufacturing

3-Oxetanemethanol, 3-ethyl-: ACTIVE

Applications

Uses3-Ethyl-3-oxetanemethanol is used as pharmaceutical intermediate.

Upstream & downstream products

Suppliers100 total

国药集团化学试剂有限公司86-21-63210123 · [email protected]
上海利卡斯实业有限公司19821976800 · [email protected]
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]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

Related reactions

33 records
New reaction record

Compound notes

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