Basic information
- CAS
625-31-0- Standard SMILES
C=CCC(C)O- InChIKey
ZHZCYWWNFQUZOR-UHFFFAOYSA-N- Molecular formula
- C5H10O
- Average molar mass
- 86.13 g/mol
- Monoisotopic mass
- 86.07316494
Overview
4-Penten-2-ol has been reported in Sphagneticola trilobata with data available.
Names & identifiers
- Preferred name
- 4-Penten-2-OL
- IUPAC
- pent-4-en-2-ol
- English name
- 4-PENTEN-2-OL
- Molecular formula
- C5H10O
- Molecular weight
- 86.13
Names & synonyms
4-PENTEN-2-OL625-31-0pent-4-en-2-ol1-Penten-4-ol4-Hydroxypent-1-eneMFCD00004556penten-4-olNSC65447EINECS 210-887-8NSC 65447Allyl methyl carbinolAI3-28609
Show more names
(S)-pent-4-en-2-ol4-PENTENE-2-OL4-Penten-2-ol>4-pentylene-2-ol4-Penten-2-ol,96%4-Penten-2-ol,99%4-Penten-2-ol 99%
4-Penten-2-ol, 99%4-Penten-2-ol (stabilised)CH2=CHCH2CH(OH)CH3SCHEMBL181264SCHEMBL315363SCHEMBL370579SCHEMBL4588387SCHEMBL5616883
Database identifiers
- CAS
625-31-0- PubChem CID
- 12247
- DTXSID
DTXSID10862318- EC Number
- 210-887-8
- Nikkaji
- J81G
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 41.2
Experimental & physicochemical properties
PolymersOther Classes -> Alcohols and Polyols, Other
Physical DescriptionClear colorless liquid; [Acros Organics MSDS]
Physicochemical properties
- Melting point
- 25.74 °C · 25.74°C
- Boiling point
- 115 · 115-116 °C (lit.)
- Density
- 0.837 g/mL · 0.837 g/mL at 25 °C (lit.)
- refractive index
- 20 · n20/D 1.424(lit.)
- Flash point
- 78 °F · 78 °F
- storage temp.
- Flammables area
- form
- Liquid
- pka
- 15.1 · 15.10±0.20(Predicted)
- Specific Gravity
- 0.837 · 0.837
- color
- Clear colorless
- Odor
- fruity
- BRN
- 1839744 · 1839744
- InChI
- 1S/C5H10O/c1-3-4-5(2)6/h3,5-6H,1,4H2,2H3
- InChIKey
- ZHZCYWWNFQUZOR-UHFFFAOYSA-N
- SMILES
- CC(O)CC=C
- LogP
- 1.033 · 1.033 (est)
- CAS DataBase Reference
- 625 · 625-31-0(CAS DataBase Reference)
- EPA Substance Registry System
- 4 · 4-Penten-2-ol (625-31-0)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 2 · GHS02
- Signal word
- Warning
- Hazard statements
- 226 · H226
- Precautionary statements
- 210 · P210-P240-P241-P280a-P303+P361+P353-P501a
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- Hazard Codes
- 226 · Xn,F,H226
- Risk Statements
- 10 · 10
- Safety Statements
- 23 · 23-24/25-16
- RIDADR
- 1987 · UN 1987 3/PG 3
- WGK Germany
- 3 · 3
- F
- 10 · 10-23
- TSCA
- TSCA listed
- HazardClass
- 3 · 3
- PackingGroup
- III
- HS Code
- 29052990 · 29052990
- Storage Class
- 3 · 3 - Flammable liquids
- Hazard Classifications
- 3 · Flam. Liq. 3
- Limited Quantities
- 5 L · 5.0 L (1.3 gallons) (liquid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
Safety & regulation
GHS classification
GHS Classification
Warning
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 45 reports by companies from 2 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory InformationChemical: 4-Penten-2-ol
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Hazards SummaryA respiratory tract irritant; [Acros Organics MSDS]
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
Safety data
- F
- 10-23
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 1987 3/PG 3
- hs_code
- 29052990
- risk_code
- 10
- Signal word
- Warning
- Symbol(GHS)
- GHS02
- hazard_code
- Xn,F,H226
- safety_code
- 23-24/25-16
- hazard_class
- 3
- Storage Class
- 3 - Flammable liquids
- packing_group
- III
- Hazard statements
- H226
- Limited Quantities
- 5.0 L (1.3 gallons) (liquid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
- Hazard Classifications
- Flam. Liq. 3
- Precautionary statements
- P210-P240-P241-P280a-P303+P361+P353-P501a
Chemistry & industry
Uses & manufacturing
General Manufacturing Information4-Penten-2-ol: INACTIVE
Upstream & downstream products
Downstream products
Suppliers61 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海鹏鹊化学科技有限公司15317013857 15901926503 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
湖北威德利化学试剂有限公司181-6332-1995 18062128043 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
湖北魏氏化学试剂股份有限公司17771898297 13125137661 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]
天津希恩思生化科技有限公司400 638 7771 · [email protected]
赛默飞世尔科技（中国）有限公司800-810-5118 · [email protected]
北京伊诺凯科技有限公司400-810-7969 010-59572699 · [email protected]
上海健超生物科技有限公司150-2103-5486 18017383231 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
上海鑫圭生物科技有限公司15121041756 · [email protected]
上海麦克林生化科技股份有限公司15221275939 15221275939 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
湖北川合化工有限公司187-7130-7593 18672969259 · [email protected]
R&D Scientific Inc.+1-2266000236 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
北京伊万景瑞生物科技有限公司15866847540 · [email protected]
武汉凯威斯科技有限公司027-67849912 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
上海颖心实验室设备有限公司021-021-59178156 15300768757 · [email protected]
成都华纯科技有限公司400-1166-196 15982826727 · [email protected]
上海贤鼎生物科技有限公司021-021-52271985 17721149837 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
上海臻励生物科技有限公司021-16621358918; 18516310516;16621358918;13045646768 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
北京珐默兹医药科技有限公司010-80339217; 13331045123 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
天津希恩思生化科技有限公司400-6387771-6039 18920764717 · [email protected]
上海吉至生化科技有限公司021-4009004166/18616739031 18616739031 · [email protected]
北京迈瑞达科技有限公司010-82387566 · [email protected]
TCI Chemicals (India) Pvt. Ltd.[email protected]
Aladdin Scientific[email protected]
湖北摆渡化学有限公司027-59106051 13627137652 · [email protected]
湖北达豪化工有限公司027-027-59106191 13986034860 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Related reactions
99 records
Compound notes
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