CAS 1125-78-6 5,6,7,8-Tetrahydro-2-naphthol (HCID 14305)

이름 및 식별자

우선 이름: 5,6,7,8-Tetrahydro-2-naphthol
IUPAC: 5,6,7,8-tetrahydronaphthalen-2-ol
영어명: 5,6,7,8-Tetrahydro-2-naphthol
분자식: C10H12O
분자량: 148.2

이름 및 동의어

5,6,7,8-Tetrahydro-2-naphthol1125-78-66-Tetralinol5,6,7,8-tetrahydronaphthalen-2-ol6-Hydroxytetralin2-Naphthalenol, 5,6,7,8-tetrahydro-5,6,7,8-Tetrahydro-beta-naphtholac-beta-Tetralol5,6,7,8-Tetrahydro-2-hydroxynaphthalene2-NAPHTHOL, 5,6,7,8-TETRAHYDRO-21664-09-5TMR02I7N8S

이름 더 보기

5,6,7,8-Tetrahydro-2-napthol5,6,7,8-tetrahydro-2-naphthalenolAR-BETA-TETRALOL6-Tetralinolagon6-Hydroxytetraline

NSC-65604CHEBI:344485,6,7,8-tetrahydronaphth-2-ol5678-TH-2NRefChem:101087214-410-4tetralin-6-ol2-hydroxy-5,6,7,8-tetrahydronaphthalene

데이터베이스 식별자

CAS: 1125-78-6、21664-09-5
PubChem CID: 14305
DTXSID: DTXSID50870851
ChEBI: CHEBI:34448
UNII: TMR02I7N8S
EC Number: 214-410-4
Nikkaji: J7.268K

물성

구조 계산 물성

XLogP: 2.9
극성 표면적: 20.2 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 1
회전 가능 결합 수: 0
무거운 원자 수: 11
형식 전하: 0
복잡도: 133

물리화학적 성질

녹는점: 59 · 59-61 °C (lit.)
끓는 점: 275 · 275-276 °C (lit.)
밀도: 1.0552 · 1.0552
굴절률: 1.5 · 1.5000 (estimate)
인화점: 230 °F · >230 °F
저장 조건: Inert atmosphere,Room Temperature
용해도: 1.5 g/L · 1.5g/L
물리적 상태: 결정질 덩어리
산도 계수 (pKa): 10.48 · 10.48(at 25℃)
색상: 베이지색
수용성: 1.5 g/L · 1.5g/L(20℃)
BRN: 1101302 · 1101302
InChI: 1S/C10H12O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h5-7,11H,1-4H2
InChIKey: UMKXSOXZAXIOPJ-UHFFFAOYSA-N
SMILES: Oc1ccc2CCCCc2c1
NIST: 2 · 2-Naphthalenol, 5,6,7,8-tetrahydro-(1125-78-6)

화학적 성질

beige crystalline mass

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]；H335 (97.8%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 45 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；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.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (97.8%)

안전 데이터

wgk: 3
rtecs: QL5300000
HS 번호: 29071900
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-37/39
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

응용 분야

용도5,6,7,8-Tetrahydro-2-naphthol was used as a model compound in the study of photochemical transformation of 17β-estradiol (natural estrogenic steroid) and 17α-ethinylestradiol (synthetic oral contraceptive).

상·하류 제품 정보

상류 원료

하류 제품

7-히드록시-1-테트라론

공급사100 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]

上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]

Shanghai Yingrui Biopharma Co.,Ltd21-33585366 · [email protected]

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

추가 설명

정의ChEBI: A member of the class tetralins that is 1,2,3,4-tetrahydronaphthalene which is substituted at position 6 by a hydroxy group.

화합물 노트

불러오는 중…

5,6,7,8-Tetrahydro-2-naphthol

기본 정보