4-叔丁基环己醇，异构体混合物

Description

4-tert-Butylcyclohexanol, mixture of isomers · CAS 98-52-2 · C10H20O. UNII L5067JRJ73. Vapor Pressure: 0.005 [mmHg]; LogP: 3.09.

Identification

CAS Registry Number	98-52-2
PubChem CID	7391
Molecular formula	C10H20O
IUPAC name	4-tert-butylcyclohexan-1-ol
UNII (FDA)	L5067JRJ73

Computed Descriptors

Molecular Weight	156.26
XLogP3	3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	156.151415257
Monoisotopic Mass	156.151415257
Topological Polar Surface Area	20.2
Heavy Atom Count	11
Formal Charge	0

Physical & Chemical Properties

Vapor Pressure	0.005 [mmHg]
LogP	3.09

Physical description & handling notes

• Dry Powder; CBI; Liquid
• White powder; [Sigma-Aldrich MSDS]

Regulatory Status

GHS notification summary	13.5% (240 / 1779)

GHS Hazard Classification

GHS notification summary	13.5% (240 / 1779)
Reported hazard statements	H319 (86.5%), H315 (100%), H335 (100%)

Documented Uses

• Used mainly in soap perfumes; Also used as a precursor for its acetate ester, which is more widely used as a fragrance; [EPA ChAMP: Submission] Used to make fine chemicals and as a laboratory reagent; [ExPub: ECHA REACH Registrations]
• Information on 8 consumer products that contain 4-T-Butylcyclohexanol in the following categories is provided:
• All Other Chemical Product and Preparation Manufacturing
• Cyclohexanol, 4-(1,1-dimethylethyl)-: ACTIVE
• Cyclohexanol, 4-(1,1-dimethylethyl)-, cis-: ACTIVE

Synonyms

4-tert-Butylcyclohexanol; 98-52-2; Cyclohexanol, 4-(1,1-dimethylethyl)-; Padaryl; CYCLOHEXANOL, 4-tert-BUTYL-; DTXSID5026623; DTXCID606623; K0H1405S9C; NSC-404197; PATCHONE; RefChem:100517; 202-676-4; 937-05-3; cis-4-tert-Butylcyclohexanol; 21862-63-5; trans-4-tert-butylcyclohexanol

Frequently Asked Questions

What are the CAS number and molecular formula of 4-tert-Butylcyclohexanol, mixture of isomers?

CAS 98-52-2; molecular formula C10H20O; molecular weight — g/mol.

What other names is 4-tert-Butylcyclohexanol, mixture of isomers known by?

4-tert-Butylcyclohexanol, 98-52-2, Cyclohexanol, 4-(1,1-dimethylethyl)-, Padaryl, CYCLOHEXANOL, 4-tert-BUTYL-, DTXSID5026623.

Is 4-tert-Butylcyclohexanol, mixture of isomers classified as hazardous?

13.5% of GHS notifications report no hazard classification (240 of 1779).

What are the key physical properties of 4-tert-Butylcyclohexanol, mixture of isomers?

Vapor Pressure: 0.005 [mmHg]; LogP: 3.09.

Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.