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Details

Stereochemistry ACHIRAL
Molecular Formula C5H10O2
Molecular Weight 102.1317
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,3-DIOXEPANE

SMILES

C1CCOCOC1

InChI

InChIKey=CZLMRJZAHXYRIX-UHFFFAOYSA-N
InChI=1S/C5H10O2/c1-2-4-7-5-6-3-1/h1-5H2

HIDE SMILES / InChI

Molecular Formula C5H10O2
Molecular Weight 102.1317
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Conformational analysis of cis-3, 5-dioxa-bicyclo[5.4.0]undecane and its 4-substituted derivatives by DNMR, molecular modeling, and GIAO/DFT methods.
2010-09
Synthesis of marine polycyclic polyethers via endo-selective epoxide-opening cascades.
2010-03-19
2,5-O-methylene-D-mannitol: two polymorphs and the NaI complex.
2001-04
Substance Class Chemical
Created
by admin
on Mon Mar 31 18:51:41 GMT 2025
Edited
by admin
on Mon Mar 31 18:51:41 GMT 2025
Record UNII
06TKO0IFJN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,3-DIOXEPANE
Systematic Name English
NSC-62077
Preferred Name English
TETRAMETHYLENE FORMAL
Common Name English
1,3-DIOXEPAN
Systematic Name English
FORMALDEHYDE, CYCLIC TETRAMETHYLENE ACETAL
Common Name English
1,3-DIOXACYCLOHEPTANE
Systematic Name English
1,3-DIOXEPIN, TETRAHYDRO-
Systematic Name English
1,4-BUTANEDIOL FORMAL
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
208-015-6
Created by admin on Mon Mar 31 18:51:41 GMT 2025 , Edited by admin on Mon Mar 31 18:51:41 GMT 2025
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FDA UNII
06TKO0IFJN
Created by admin on Mon Mar 31 18:51:41 GMT 2025 , Edited by admin on Mon Mar 31 18:51:41 GMT 2025
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EPA CompTox
DTXSID0029183
Created by admin on Mon Mar 31 18:51:41 GMT 2025 , Edited by admin on Mon Mar 31 18:51:41 GMT 2025
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NSC
62077
Created by admin on Mon Mar 31 18:51:41 GMT 2025 , Edited by admin on Mon Mar 31 18:51:41 GMT 2025
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CAS
505-65-7
Created by admin on Mon Mar 31 18:51:41 GMT 2025 , Edited by admin on Mon Mar 31 18:51:41 GMT 2025
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PUBCHEM
68162
Created by admin on Mon Mar 31 18:51:41 GMT 2025 , Edited by admin on Mon Mar 31 18:51:41 GMT 2025
PRIMARY