Basic information
- CAS
34371-14-7- Standard SMILES
O=C1C[C@H](O)[C@@H](CO)O1- InChIKey
YIXDEYPPAGPYDP-IUYQGCFVSA-N- Molecular formula
- C5H8O4
- Average molar mass
- 132.11 g/mol
- Monoisotopic mass
- 132.04225874
Overview
2-deoxy-D-ribono-1,4-lactone is a ribonolactone. It has a role as a metabolite. It is functionally related to a D-ribonic acid.
Names & identifiers
- Preferred name
- 2-Deoxy-D-Ribono-1,4-Lactone
- IUPAC
- (4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-one
- English name
- 2-Deoxy-D-ribonic-1,4-lactone
- Molecular formula
- C5H8O4
- Molecular weight
- 132.11
Names & synonyms
34371-14-7(4S,5R)-4-hydroxy-5-(hydroxymethyl)dihydrofuran-2(3H)-one2-deoxy-D-ribono-1,4-lactone2-Deoxy-ribono-1,4-lactone2,4,5-Trihydroxypentanoic acid gamma-lactoneCHEBI:17281DTXSID501308989RefChem:471278DTXCID201738884(4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-one2-Deoxyribonolactone2-Deoxy-D-ribonic-1,4-lactone
Show more names
2'-Deoxyribonolactone2-deoxy-D-ribonolactone2-Deoxy-D-ribonic acid γ-lactone2-Deoxy-D-ribono-1,4-lactone >=95% (GC)
Deoxyribonolactone2-Deoxy-D-ribonic acid-1,4-lactoneMFCD1514495273209-20-8rel-(4S,5R)-4-Hydroxy-5-(hydroxymethyl)dihydrofuran-2(3H)-one2-deoxy-D-erythro-pentonic acid gamma-lactone2'-Deoxyribolactone2-Deoxy
Database identifiers
- CAS
34371-14-7- PubChem CID
- 161815
- DTXSID
DTXSID501308989
Properties
Computed structural properties
- XLogP
- -0.9
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 122
Physicochemical properties
- Boiling point
- 395.3 · 395.3±27.0 °C(Predicted)
- Density
- 1.438 · 1.438±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C
- pka
- 12.63 · 12.63±0.40(Predicted)
- Appearance
- Light yellow to yellow Liquid
- optical activity
- 19 · [α]/D 19.0±2.5°, c = 1 in H2O
- BRN
- 81260 · 81260
- InChI
- InChI=1/C5H8O4/c6-2-4-3(7)1-5(8)9-4/h3-4,6-7H,1-2H2/t3-,4+/s3
- InChIKey
- YIXDEYPPAGPYDP-IUYQGCFVSA-N
- SMILES
- C1(O[C@H](CO)[C@@H](O)C1)=O |&1:2,5,r|
- UNSPSC Code
- 12352201 · 12352201
- NACRES
- 25 · NA.25
- WGK Germany
- 3 · 3
- Storage Class
- 13 · 13 - Non Combustible Solids
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- wgk
- 3
- Storage Class
- 13 - Non Combustible Solids
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers62 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
Aladdin Scientific[email protected]
南京百芙利科技有限责任公司25-25-58740604 15951658055 · [email protected]
韶远科技（上海）有限公司4000665055 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
南京药石科技股份有限公司025-86918202 4000255188 · [email protected]
杭州璟皓生物科技有限公司（原河南辛迪加生物）
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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