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3-(hydroxymethyl)oxetan-3-ol - 97%, high purity , CAS No.16563-93-2

COA

Grade & Purity:

≥97%

Cas Number: 16563-93-2
Molecular Weight: 104.1045
PubChem CID: 53346593

In stock

Item Number

H174871

Grouped product items
SKU	Size	Availability	Price	Qty
H174871-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$3,421.90

Basic Description

Synonyms	3-(Hydroxymethyl)oxetan-3-ol \| 16563-93-2 \| 3-Oxetanemethanol, 3-hydroxy- \| 3-hydroxy-3-hydroxymethyloxetane \| MFCD18909287 \| SCHEMBL6124717 \| DTXSID00693532 \| AKOS015907308 \| PB41149 \| AS-53045 \| SY270294 \| CS-0051683 \| FT-0751588 \| P16013 \| A852907
Specifications & Purity	≥97%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic oxygen compounds
  - Class Organooxygen compounds
    - Subclass Alcohols and polyols

Kingdom	Organic compounds
Superclass	Organic oxygen compounds
Class	Organooxygen compounds
Subclass	Alcohols and polyols
Intermediate Tree Nodes	Not available
Direct Parent	Tertiary alcohols
Alternative Parents	Oxetanes 1,2-diols Oxacyclic compounds Dialkyl ethers Primary alcohols Hydrocarbon derivatives
Molecular Framework	Aliphatic heteromonocyclic compounds
Substituents	Tertiary alcohol - Oxetane - 1,2-diol - Oxacycle - Organoheterocyclic compound - Ether - Dialkyl ether - Hydrocarbon derivative - Primary alcohol - Aliphatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as tertiary alcohols. These are compounds in which a hydroxy group, -OH, is attached to a saturated carbon atom R3COH (R not H ).
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	3-(hydroxymethyl)oxetan-3-ol
INCHI	InChI=1S/C4H8O3/c5-1-4(6)2-7-3-4/h5-6H,1-3H2
InChIKey	TVRBHJADIOFJDI-UHFFFAOYSA-N
Smiles	C1C(CO1)(CO)O
Isomeric SMILES	C1C(CO1)(CO)O
Molecular Weight	104.1045
Reaxy-Rn	19205589
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=19205589&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	104.100 g/mol
XLogP3	-1.600
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	104.047 Da
Monoisotopic Mass	104.047 Da
Topological Polar Surface Area	49.700 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	67.300
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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