3-(Hydroxymethyl)oxetane-3-carboxylic Acid - CAS 1379325-60-6

Catalog:	BB008680
Product Name:	3-(Hydroxymethyl)oxetane-3-carboxylic Acid
CAS:	1379325-60-6
Synonyms:	3-(hydroxymethyl)-3-oxetanecarboxylic acid; 3-(hydroxymethyl)oxetane-3-carboxylic acid

Technical Data

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Computed Properties

IUPAC Name:	3-(hydroxymethyl)oxetane-3-carboxylic acid
Description:	3-(Hydroxymethyl)oxetane-3-carboxylic Acid (CAS# 1379325-60-6) is a useful research chemical.
Molecular Weight:	132.11
Molecular Formula:	C5H8O4
Canonical SMILES:	C1C(CO1)(CO)C(=O)O
InChI:	InChI=1S/C5H8O4/c6-1-5(4(7)8)2-9-3-5/h6H,1-3H2,(H,7,8)
InChI Key:	OBAXXYDVDRRLAY-UHFFFAOYSA-N
Storage:	Sealed in dry, 2-8 °C
LogP:	3.15180

Publication Number	Title	Priority Date
AU-2016215432-A1	3-alkyl-4-amido-bicyclic [4,5,0] hydroxamic acids as HDAC inhibitors	20150202
CA-2975605-A1	3-alkyl-4-amido-bicyclic [4,5,0] hydroxamic acids as hdac inhibitors	20150202
EP-3253747-A1	3-alkyl-4-amido-bicyclic [4,5,0]hydroxamic acids as hdac inhibitors	20150202
EP-3253747-B1	3-alkyl-4-amido-bicyclic [4,5,0]hydroxamic acids as hdac inhibitors	20150202
JP-2018503674-A	3-Alkyl-4-amido-bicyclic [4,5,0] hydroxamic acids as HDAC inhibitors	20150202

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Related Functional Groups

Oxetane/Thietane

[1864252-66-3]
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[1193389-20-6]
oxalic acid; oxetan-3-amine
[2227205-45-8]
2,2-diethyloxetan-3-amine
[1245816-27-6]
1-Boc-6-oxa-1-azaspiro[3.3]heptane
[569678-81-5]
3-[2-(Benzyloxy)ethyl]oxetane
[1803571-63-2]
N-methoxy-N,3-dimethyloxetane-3-carboxamide

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	127
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	132.04225873
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	132.04225873
Rotatable Bond Count:	2
Topological Polar Surface Area:	66.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-1.5