Basic information
- CAS
6196-58-3- Standard SMILES
CCCCCOCCO- InChIKey
QVQDALFNSIKMBH-UHFFFAOYSA-N- Molecular formula
- C7H16O2
- Average molar mass
- 132.2 g/mol
- Monoisotopic mass
- 132.11502975
Names & identifiers
- Preferred name
- 2-(Pentyloxy)ethanol
- IUPAC
- 2-pentoxyethanol
- English name
- C5E1
- Molecular formula
- C7H16O2
- Molecular weight
- 132.2
Names & synonyms
6196-58-32-(Pentyloxy)ethanolDTXSID40334816RefChem:1061966DTXCID902859052-(pentyloxy)ethan-1-ol2-pentoxyethanolEthyleneglycolmonopentyletherC5E1CE;n-PentylmonooxyethyleneEthanol, 2-(pentyloxy)-MFCD00077908
Show more names
C5E1, n-PentylMonooxyethyleneETHYLENEGLYCOLMONOPENTYL ETHER
3-Oxaoctane-1-olPentylglycol2-pentyloxy-1-ethanolC;n-Pentylmonooxyethyleneethylene glycol amyl ether2-(1-Pentyloxy) ethanolN-PENTYLMONOOXYETHYLENESCHEMBL175116
Database identifiers
- CAS
6196-58-3- PubChem CID
- 522003
- DTXSID
DTXSID40334816- Nikkaji
- J191.554A
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 46.2
Physicochemical properties
- Melting point
- -15.45 °C · -15.45°C (estimate)
- Boiling point
- 179.14 °C · 179.14°C (rough estimate)
- Density
- 0.893 g/mL · 0.893 g/mL at 20 °C(lit.)
- refractive index
- 20 · n20/D 1.424
- Flash point
- 75 °C · 75 °C
- storage temp.
- -15 °C · -15°C
- pka
- 14.42 · 14.420±0.10(predicted)
- RIDADR
- 2810 · 2810
- WGK Germany
- 3 · 3
- F
- 10 · 10-23
- HazardClass
- 6.1 · 6.1(b)
- PackingGroup
- III
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- F
- 10-23
- wgk
- 3
- ridadr
- 2810
- hazard_class
- 6.1(b)
- packing_group
- III
Chemistry & industry
Suppliers14 total
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
武汉丰泰威远科技有限公司+86-27-8746-5837 +86-18627785180 · [email protected]
武汉丰泰威远科技有限公司027-87465837 19945049750 · [email protected]
武汉艾瑞尔化学科技有限公司18986259541 18986259541 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
珠海柏瑞医药科技有限公司0756-8699456 13427714006 · [email protected]
南京佰瑞利康生物科技有限公司18168036974 · [email protected]
安那莱（齐河）新材料科技有限公司18600642180（微信同） 13391601435 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
Nextpeptide Inc+86-0571-81612335 +8613336028439 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Beri Pharma Co., Ltd.
Related reactions
2 records
Compound notes
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