CAS 1173020-38-6|4-(3,6-Dimethyl-3-heptyl)phenol-ring-13C6 solution

Introduction：Basic information about CAS 1173020-38-6|4-(3,6-Dimethyl-3-heptyl)phenol-ring-13C6 solution, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. BiologicalActivity
3. Chemical & Physical Properties
4. Safety Information
5. Synonyms

Common Name	4-(3,6-Dimethyl-3-heptyl)phenol-ring-13C6 solution
CAS Number	1173020-38-6	Molecular Weight	226.30600
Density	/	Boiling Point	/
Molecular Formula	C₁₅H₂₄O	Melting Point	/
MSDS	ChineseUSA	Flash Point	-17 °C
Symbol	GHS02, GHS07, GHS08	Signal Word	Danger

Names

Name	4-(3,6-Dimethyl-3-heptyl)phenol-ring-13C6 solution
Synonym	More Synonyms

BiologicalActivity

Description	4-(3,6-Dimethylhept-3-yl)phenol-13C6 is the 13C6 labeled 4-(3,6-Dimethylhept-3-yl)phenol.
Related Catalog	Research Areas >>OthersSignaling Pathways >>Others >>Others
In Vitro	Stable heavy isotopes of hydrogen, carbon, and other elements have been incorporated into drug molecules, largely as tracers for quantitation during the drug development process. Deuteration has gained attention because of its potential to affect the pharmacokinetic and metabolic profiles of drugs[1].
References	[1]. Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019;53(2):211-223.

Chemical & Physical Properties

Molecular Formula	C₁₅H₂₄O
Molecular Weight	226.30600
Flash Point	-17 °C
Exact Mass	226.20300
PSA	20.23000
LogP	4.49610
InChIKey	BGLUSMSXKMBLFS-FQPQTBQFSA-N
SMILES	CCC(C)(CCC(C)C)c1ccc(O)cc1
Storage condition	−20°C

Safety Information

Symbol	GHS02, GHS07, GHS08
Signal Word	Danger
Hazard Statements	H225-H319-H336-H361
Supplemental HS	Repeated exposure may cause skin dryness or cracking.
Precautionary Statements	P201-P210-P280-P304 + P340 + P312-P308 + P313-P337 + P313
Hazard Codes	F,Xi
Risk Phrases	11-36-66-67
Safety Phrases	9-16-26
RIDADR	UN 1090 3/PG 2

Synonyms

3,6,3-Nonylphenol-13C6,363-NP-13C6,4-(1-Ethyl-1,4-dimethylpentyl)phenol-13C6

4-(3,6-Dimethyl-3-heptyl)phenol-ring-13C6

4-(3,6-dimethylheptan-3-yl)phenol

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