4,4′-부틸리덴비스(3-메틸-6-t-부틸페놀)

4,4′-부틸리덴비스(3-메틸-6-t-부틸페놀) · 4,4'-뷰틸리덴비스(6-tert-뷰틸-M-크레솔) · 4,4'-부틸리덴비스(6-tert-부틸-3-메틸페놀) · bbm · 4,4'-Butylidenebis(6-tert-butyl-m-cresol) · swp · BBMC · XFJ63

https://huagongshe.com/ko/chemical/6815

식별자 및 물리적 특성

CAS No.	85-60-9
분자식	C26H38O2
평균 분자량	382.6 g/mol
단동위원소 질량	382.28718045 g/mol
SMILES	CCCC(c1cc(C(C)(C)C)c(O)cc1C)c1cc(C(C)(C)C)c(O)cc1C
InChIKey	PFANXOISJYKQRP-UHFFFAOYSA-N
PubChem CID	6815
ChEMBL	CHEMBL1337629
EC No.	201-618-5
DTXSID	DTXSID8029602
현지명	4,4′-부틸리덴비스(3-메틸-6-t-부틸페놀)

화학 및 물리적 성질

XLogP	8.6
극성 표면적	40.5
수소 결합 공여자 수	2
수소 결합 수용자 수	2
회전 가능 결합 수	6
무거운 원자 수	28
형식 전하	0
복잡도	444
밀도	1.03 @ 25 °C0.9598 (rough estimate)
Color/Form	WHITE POWDER
녹는점	209 °C211°C
Physical Description	Dry PowderWhite solid[HSDB] White to off-white powder[MSDSonline]
끓는 점	469.7°C (rough estimate)
증기압	0Pa at 25℃
굴절률	1.4875 (estimate)
저장 조건	Inert atmosphere,Room Temperature
용해도	almost transparency in Methanol
물리적 상태	powder to crystal
pKa(산도 계수)	10.44±0.20(Predicted)
색상	흰색에서 거의 흰색
용해도	4μg/L at 20℃
InChIKey	PFANXOISJYKQRP-UHFFFAOYSA-N
LogP(분배 계수)	6.4 at 20℃
EPA	4,4'-Butylidenebis[6-tert-butyl-m-cresol] (85-60-9)

안전 및 규제

GHS 분류	This chemical does not meet GHS hazard criteria for 41.1% (120 of 292) of reports.WarningH315 (15.4%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (15.4%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (14.4%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]H410 (24.3%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]H412 (18.8%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]H413 (14.7%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 292 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Reported as not meeting GHS hazard criteria per 120 of 292 reports by companies.There are 8 notifications provided by 172 of 292 reports by companies with hazard statement code(s).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.
규제 정보	Chemical: Phenol, 4,4'-butylidenebis[2-(1,1-dimethylethyl)-5-methyl-Phenol, 4,4'-butylidenebis[2-(1,1-dimethylethyl)-5-methyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Phenol, 4,4'-butylidenebis[2-(1,1-dimethylethyl)-5-methyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)Status: Active Update: 05-08-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/13368Phenol, 4,4'-butylidenebis[2-(1,1-dimethylethyl)-5-methyl-: Does not have an individual approval but may be used under an appropriate group standard

GHS 분류

This chemical does not meet GHS hazard criteria for 41.1% (120 of 292) of reports.WarningH315 (15.4%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (15.4%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (14.4%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]H410 (24.3%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]H412 (18.8%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]H413 (14.7%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 292 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Reported as not meeting GHS hazard criteria per 120 of 292 reports by companies.There are 8 notifications provided by 172 of 292 reports by companies with hazard statement code(s).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.

규제 정보

Chemical: Phenol, 4,4'-butylidenebis[2-(1,1-dimethylethyl)-5-methyl-Phenol, 4,4'-butylidenebis[2-(1,1-dimethylethyl)-5-methyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Phenol, 4,4'-butylidenebis[2-(1,1-dimethylethyl)-5-methyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)Status: Active Update: 05-08-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/13368Phenol, 4,4'-butylidenebis[2-(1,1-dimethylethyl)-5-methyl-: Does not have an individual approval but may be used under an appropriate group standard

용도

4,4'-Butylidenebis(6-tert-butyl-3-methylphenol) is mainly used as a variety of polyolefin and rubber antioxidant.