2-(2,4-Dihydroxyphenyl)-4,6-diphenyl-1,3,5-triazine

HCID 135437125

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 38369-95-8
표준 SMILES: Oc1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c(O)c1
InChIKey: YCNFNXPUWNPXMG-UHFFFAOYSA-N
분자식: C21H15N3O2
평균 분자량: 341.4 g/mol
단동위원소 질량: 341.11642673

이름 및 식별자

우선 이름: 2-(2,4-Dihydroxyphenyl)-4,6-diphenyl-1,3,5-triazine
IUPAC: 4-(4,6-diphenyl-1,3,5-triazin-2-yl)benzene-1,3-diol
영어명: 1,3-Benzenediol, 4-(4,6-diphenyl-1,3,5-triazin-2-yl)-
분자식: C21H15N3O2
분자량: 341.36

이름 및 동의어

2-(2,4-dihydroxyphenyl)-4,6-diphenyl-1,3,5-triazineRefChem:451993805-575-938369-95-84-(4,6-Diphenyl-1,3,5-triazin-2-yl)benzene-1,3-diolMFCD162511261,3-Benzenediol, 4-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4,6-diphenyl-1,3,5-triazin-2-yl)-1,3-benzenediol4,6-Diphenyl-2-(2,4-dihydroxyphenyl)-s-triazineSCHEMBL1243192CS-0435400WTC578XQ2A

이름 더 보기

UV-1161,3-Benzenediol, 4- 4,6-bis(2,4-diMethylphenyl)-3-Benzenediol, 4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-92-,4-dihydroxyphenyl)-4,6-diphenyl-1,3,5-triazine2-(2,4-Dihydroxyphenyl)-4,6-diphenyl-1,3,5-triazine (Appolo-116)2-(2,4-Dihydroxyphenyl)-4,6-diphenyl-1,3,5-triazine (Stellar-2016)

SCHEMBL14780457SCHEMBL29649729DTXSID105783212-(2,4-dihydroxyphenyl)-4,6-diphenyAS-86981SY056209DB-020081D4819

데이터베이스 식별자

CAS: 38369-95-8
PubChem CID: 135437125
UNII: WTC578XQ2A
EC Number: 805-575-9
Nikkaji: J1.052.110F

물성

구조 계산 물성

XLogP: 4.2
극성 표면적: 79.1 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 5
회전 가능 결합 수: 3
무거운 원자 수: 26
형식 전하: 0
복잡도: 411

물리화학적 성질

녹는점: 276 °C · 276°C(lit.)
끓는 점: 638.4 · 638.4±48.0 °C(Predicted)
밀도: 1.303 · 1.303±0.06 g/cm3(Predicted)
물리적 상태: powder to crystal
산도 계수 (pKa): 8.6 · 8.60±0.40(Predicted)
색상: White to Yellow to Green

안전 및 규제

GHS 분류

GHS Classification · 5건

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.