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(4-Phenylcyclohexyl)methanol

HCID 3100608
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
83811-73-8
Standard SMILES
OCC1CCC(c2ccccc2)CC1
InChIKey
SRPDEHMURXAMGW-UHFFFAOYSA-N
Molecular formula
C13H18O
Average molar mass
190.28 g/mol

Names & identifiers

Preferred name
(4-Phenylcyclohexyl)methanol
IUPAC
(4-phenylcyclohexyl)methanol
English name
(4-PHENYLCYCLOHEXYL)METHANOL
Molecular formula
C13H18O
Molecular weight
190.28

Names & synonyms

(4-phenylcyclohexyl)methanol83811-73-887073-90-3(Trans-4-phenylcyclohexyl)methanolMFCD00610041[(1r,4r)-4-phenylcyclohexyl]methanolCyclohexanemethanol, 4-phenyl-, trans-4-phenylcyclohexylmethanol4-phenyl-cyclohexylmethanol4-phenyl-cyclohexylmethylalcoholSCHEMBL5756827SCHEMBL10881534
Show more names
Cyclohexanemethanol, 4-phenyl-trans-4-phenylcyclohexylmethanol
SCHEMBL17729950Cis-(4-phenylcyclohexyl)methanolSRPDEHMURXAMGW-BJHJDKERSA-NSRPDEHMURXAMGW-UHFFFAOYSA-NIDA81173MDA07390AKOS006242090CCG-320289

Database identifiers

CAS
83811-73-8
PubChem CID
3100608
EC Number
194-275-5
Nikkaji
J1.630.099C

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
20.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
14
Formal charge
0
Complexity
153

Physicochemical properties

Melting point
49 °C · 49 °C
Boiling point
177 · 177-178 °C(Press: 15 Torr)
Density
1.005 · 1.005±0.06 g/cm3(Predicted)
storage temp.
Sealed in dry,Room Temperature
pka
15.05 · 15.05±0.10(Predicted)

Chemistry & industry

Suppliers16 total

毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
Nantong HI-FUTURE Biology Co., Ltd.+86-18051384581 · [email protected]
台州川旭医药科技有限公司[email protected] · [email protected]
上海超岚化工科技中心(原宁波市超明生物科技有限公司)13301662590 · [email protected]
南通全益生物科技有限公司0513-66337626 18051384581 · [email protected]
深圳市创鑫生物科技有限公司13417589054 · [email protected]
上海立崎生物医学研究中心18014399201 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
上海兹浩医药科技有限公司021-13482410-12 13482410112 · [email protected]
南京合巨药业有限公司025-57027686 17372956142 · [email protected]
上海珂华生物科技有限公司021-58581007 18019463053 · [email protected]
上海蓝乐鸟实业有限公司15021845385 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD

Related reactions

10 records
New reaction record
HRID 116665 reaction equation
HRID 116665As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 358429 reaction equation
HRID 358429As productuspto-grants-1984_08
HRID 358430 reaction equation
HRID 358430As reactantuspto-grants-1984_08
HRID 427411 reaction equation
HRID 427411As productuspto-grants-2001_11
HRID 480253 reaction equation
HRID 480253As productuspto-grants-2003_11
HRID 1248095 reaction equation
HRID 1248095As productuspto-grants-1985_06
HRID 1262480 reaction equation
HRID 1262480As productuspto-grants-1984_06
HRID 2269348 reaction equation
HRID 2269348As reactantuspto-grants-2001_12
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Compound notes

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On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
+86-88938639 +86-17705817739 · [email protected]
湖北偕丰医药科技有限公司2383948258 19172820304 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]