Basic information
- CAS
1125-78-6- Standard SMILES
Oc1ccc2c(c1)CCCC2- InChIKey
UMKXSOXZAXIOPJ-UHFFFAOYSA-N- Molecular formula
- C10H12O
- Average molar mass
- 148.2 g/mol
- Monoisotopic mass
- 148.088815
Names & identifiers
- Preferred name
- 5,6,7,8-Tetrahydro-2-naphthol
- IUPAC
- 5,6,7,8-tetrahydronaphthalen-2-ol
- English name
- 5,6,7,8-Tetrahydro-2-naphthol
- Molecular formula
- C10H12O
- Molecular weight
- 148.2
Names & synonyms
5,6,7,8-Tetrahydro-2-naphthol1125-78-66-Tetralinol5,6,7,8-tetrahydronaphthalen-2-ol6-Hydroxytetralin2-Naphthalenol, 5,6,7,8-tetrahydro-5,6,7,8-Tetrahydro-beta-naphtholac-beta-Tetralol5,6,7,8-Tetrahydro-2-hydroxynaphthalene2-NAPHTHOL, 5,6,7,8-TETRAHYDRO-21664-09-5TMR02I7N8S
Show more names
5,6,7,8-Tetrahydro-2-napthol5,6,7,8-tetrahydro-2-naphthalenolAR-BETA-TETRALOL6-Tetralinolagon6-Hydroxytetraline
NSC-65604CHEBI:344485,6,7,8-tetrahydronaphth-2-ol5678-TH-2NRefChem:101087214-410-4tetralin-6-ol2-hydroxy-5,6,7,8-tetrahydronaphthalene
Database identifiers
- CAS
1125-78-6、21664-09-5- PubChem CID
- 14305
- DTXSID
DTXSID50870851- ChEBI
CHEBI:34448- UNII
- TMR02I7N8S
- EC Number
- 214-410-4
- Nikkaji
- J7.268K
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 133
Physicochemical properties
- Melting point
- 59 · 59-61 °C (lit.)
- Boiling point
- 275 · 275-276 °C (lit.)
- Density
- 1.0552 · 1.0552
- refractive index
- 1.5 · 1.5000 (estimate)
- Flash point
- 230 °F · >230 °F
- storage temp.
- Inert atmosphere,Room Temperature
- solubility
- 1.5 g/l · 1.5g/l
- form
- Crystalling Mass
- pka
- 10.48 · 10.48(at 25℃)
- color
- Beige
- Water Solubility
- 1.5 g/L · 1.5g/L(20 ºC)
- BRN
- 1101302 · 1101302
- InChI
- 1S/C10H12O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h5-7,11H,1-4H2
- InChIKey
- UMKXSOXZAXIOPJ-UHFFFAOYSA-N
- SMILES
- Oc1ccc2CCCCc2c1
- CAS DataBase Reference
- 1125 · 1125-78-6(CAS DataBase Reference)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 2 I7N8S · TMR02I7N8S
- NIST Chemistry Reference
- 2 · 2-Naphthalenol, 5,6,7,8-tetrahydro-(1125-78-6)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
- target organs
- Respiratory system
- PPE
- 95 · dust mask type N95 (US), Eyeshields, Gloves
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-37/39
- WGK Germany
- 3 · 3
- RTECS
- 5300000 · QL5300000
- HS Code
- 29071900 · 29071900
- Storage Class
- 11 · 11 - Combustible Solids
- Hazard Classifications
- 2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3
Safety & regulation
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.8%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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)
Aggregated GHS information provided per 45 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (97.8%)
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- rtecs
- QL5300000
- hs_code
- 29071900
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-37/39
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P305+P351+P338
Chemistry & industry
Applications
Uses5,6,7,8-Tetrahydro-2-naphthol was used as a model compound in the study of photochemical transformation of 17β-estradiol (natural estrogenic steroid) and 17α-ethinylestradiol (synthetic oral contraceptive).
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers100 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
Shanghai Yingrui Biopharma Co.,Ltd21-33585366 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
郑州鸿晟医药科技有限公司0371-55695890 15637198702 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [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]
广州市亿邦医药科技有限公司+86 (20) 28996708,29078958,28139708,29076128,28133708,28139728,28139738,28133718,021-31663278,021-31663578,021-60538387
南京圣亿来化工有限公司19951936396 · [email protected]
沧州维智达美制药有限公司13426038769 · [email protected]
南京唯博特医药科技有限公司18066048793; 18014498793 · [email protected]
孝感深远化工有限公司15527621225; 15527621225 · [email protected]
上海毕楷科技有限公司18516304666
玛雅试剂+86 (573) 82222445 (0)18006601000 452520369 · [email protected]
四川库利南科技有限公司400-1166-196 18981987031 · [email protected]
艾科试剂4008-755-333 18080918076 · [email protected]
上海思域化工科技有限公司86-21-34053660 · [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]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
上海睿升化工科技有限公司+86-021-50935922
湖北鑫源顺医药化工有限公司13971561712, 13995564702, 027-50664929 · [email protected]
上海湄水化工科技有限公司021-60549325 18616193163
HBCChem, Inc.+1-510-219-6317 · [email protected]
上海石洋化工有限公司021-56795766 · [email protected]
成都零六生物科技有限公司400-1166-196 13458535857 · [email protected]
上海御略医药科技有限公司021-60345187 13671753212 · [email protected]
杭州杰恒化工有限公司0571-87396432 · [email protected]
南京多隆生物科技有限公司18905173768 · [email protected]
上海嵩爰化工科技有限公司010-1234567 18521000990 · [email protected]
上海彤源化工有限公司021-021-69182866 13701855675 · [email protected]
广州市慈铭生物科技有限公司020-38082199,29065168,38082986,29878298,29866629,4000192398
上海孚一生物科技有限公司+86 (21) 61124340
北京蓝博特科技有限公司010-56330744 18310155299 · [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]
上海皓之翔生物科技有限公司（原上海拓青化工有限公司）526763801 13301653310 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
上海谱振生物科技有限公司4001650900 13817534909 · [email protected]
厦门志信化学有限公司+86-5922680277 +86-13806087780 · [email protected]
泰安嘉岳生物化工有限公司15318151873 · [email protected]
嘉兴市德亿化工有限公司0573-85866609 13325730825 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
南京世洲生物科技有限公司025-85563444 18351873721 · [email protected]
Additional notes
DefinitionChEBI: A member of the class tetralins that is 1,2,3,4-tetrahydronaphthalene which is substituted at position 6 by a hydroxy group.
Related reactions
51 records
Compound notes
Loading…