기본 정보
- 표준 SMILES
Cc1ccc(O)c(Cc2cc(C)cc(Cc3cc(C)ccc3O)c2O)c1- InChIKey
MAQOZOILPAMFSW-UHFFFAOYSA-N- 분자식
- C23H24O3
- 평균 분자량
- 348.4 g/mol
- 단동위원소 질량
- 348.17254462
이름 및 식별자
- 우선 이름
- 2,6-Bis((2-hydroxy-5-methylphenyl)methyl)-4-methylphenol
- IUPAC
- 2,6-bis[(2-hydroxy-5-methylphenyl)methyl]-4-methylphenol
- 현지명
- 2,6-BIS[(2-HYDROXY-5-메틸페닐)메틸]-4-메틸페놀
- 영어명
- 2,6-Bis[(2-hydroxy-5-methylphenyl)methyl]-4-methylphenol
- 분자식
- C23H24O3
- 분자량
- 348.43
이름 및 동의어
1620-68-42,6-Bis[(2-hydroxy-5-methylphenyl)methyl]-4-methylphenol2,6-bis(2-hydroxy-5-methylbenzyl)-4-methylphenolPhenol, 2,6-bis[(2-hydroxy-5-methylphenyl)methyl]-4-methyl-H9F7SG62G8EINECS 216-587-3NSC-634601UNII-H9F7SG62G82,6-bis((2-hydroxy-5-methylphenyl)methyl)-4-methylphenol2alpha,6alpha-Bis(6-hydroxy-m-tolyl)mesitolDTXSID0061824Phenol, 2,6-bis((2-hydroxy-5-methylphenyl)methyl)-4-methyl-
이름 더 보기
2,6-BIS[(2-HYDROXY-5-메틸페닐)메틸]-4-메틸페놀Antioxidant 80bis(methylene)bis(4-methylphenol)2,6-BIS(P-CRESOL-2-YLMETHYL)-P-CRESOLbishydroxymethylphenylmethylmethylphenol2,2'-((2-Hydroxy-5-methyl-1,3-phenylene)2,6-bis[(2-hydroxy-5-methylphenyl)methyl]p-cresol2,6-bis[(2-hydroxy-5-methylphenyl)methyl]-4-methyl-pheno
Mesitol, .alpha.2,.alpha.6-bis(6-hydroxy-m-tolyl)-.ALPHA.2,.ALPHA.6-BIS(6-HYDROXY-M-TOLYL)MESITOL2-(DI(2-HYDROXY-5-METHYL-M-PHENYLENEMETHYLENE))-P-CRESOLRefChem:83072DTXCID9035208ALPHA2,ALPHA6-BIS(6-HYDROXY-M-TOLYL)MESITOLMESITOL, ALPHA2,ALPHA6-BIS(6-HYDROXY-M-TOLYL)-216-587-3
데이터베이스 식별자
- CAS
1620-68-4- PubChem CID
- 74181
- DTXSID
DTXSID0061824- ChEMBL
CHEMBL1904421- UNII
- H9F7SG62G8
- EC Number
- 216-587-3
- Nikkaji
- J118.408C
물성
구조 계산 물성
- XLogP
- 5.8
- 극성 표면적
- 60.7 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 26
- 형식 전하
- 0
- 복잡도
- 401
물리화학적 성질
- 녹는점
- 214 °C · 214 °C
- 끓는 점
- 533.7 · 533.7±45.0 °C(Predicted)
- 밀도
- 1.191 · 1.191±0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- 9.98 · 9.98±0.43(Predicted)
- 물리적 상태
- powder to crystal
- 색상
- 흰색에서 거의 흰색
- EPA
- 2 · Phenol, 2,6-bis[(2-hydroxy-5-methylphenyl)methyl]-4-methyl- (1620-68-4)
안전 및 규제
GHS 분류
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
유해성 정보
Regulatory InformationChemical: Phenol, 2,6-bis[(2-hydroxy-5-methylphenyl)methyl]-4-methyl-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Hazard Classes and CategoriesSkin Irrit. 2 (100%);Eye Irrit. 2 (100%)
규제 정보
Regulatory InformationChemical: Phenol, 2,6-bis[(2-hydroxy-5-methylphenyl)methyl]-4-methyl-
안전 데이터
- tsca
- TSCA listed
- HS 번호
- 2907.29.9000
화학 및 산업
용도 및 제조
General Manufacturing InformationPhenol, 2,6-bis[(2-hydroxy-5-methylphenyl)methyl]-4-methyl-: INACTIVE
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