2-Methoxy-5-methylphenol

HCID 14519CAS 1195-09-1
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
COc1ccc(C)cc1O
InChIKey
IFNDEOYXGHGERA-UHFFFAOYSA-N
분자식
C8H10O2
평균 분자량
138.16 g/mol
단동위원소 질량
138.06807956

이름 및 식별자

우선 이름
2-Methoxy-5-methylphenol
IUPAC
2-methoxy-5-methylphenol
영어명
2-METHOXY-5-METHYLPHENOL
분자식
C8H10O2
분자량
138.16

이름 및 동의어

2-Methoxy-5-methylphenolIsocreosol5-MethylguaiacolPhenol, 2-methoxy-5-methyl-6-Methoxy-m-cresol2-Hydroxy-4-methylanisolem-CRESOL, 6-METHOXY-5-methyl-2-methoxyphenol3-hydroxy-4-methoxytolueneBRN 1817644EINECS 214-791-7UNII-AV5V76OU33
이름 더 보기
ISOCREOSOLE6-methoxy-m-creso5-METHYL-GUAIACOLTIMTEC-BB SBB008267
AV5V76OU33IFNDEOYXGHGERA-UHFFFAOYSA-DTXSID701524694-06-00-05879 (Beilstein Handbook Reference)3-HYDROXY-4-METHOXY-1-METHYLBENZENERefChem:87853DTXCID6074960IFNDEOYXGHGERA-UHFFFAOYSA-N

데이터베이스 식별자

CAS
1195-09-1
PubChem CID
14519
DTXSID
DTXSID70152469
ChEBI
CHEBI:194904
UNII
AV5V76OU33
EC Number
214-791-7
Nikkaji
J45.658F

물성

구조 계산 물성

XLogP
2.1
극성 표면적
29.5 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
2
회전 가능 결합 수
1
무거운 원자 수
10

실험 및 물리화학적 성질

Kovats Retention Index · 2건

1201.7；1177；1191；1194.4

1789

물리화학적 성질

녹는점
37 °C · 37 °C
끓는 점
115 °C · 115 °C
밀도
1.0742 g/cm3 · 1.0742 g/cm3(Temp: 38.60001953125 °C)
굴절률
1.534 · 1.534
인화점
115 · 115-117°C/20mm
저장 조건
2 · 2-8°C(protect from light)

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (87.5%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (75%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 8 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 CategoriesAcute Tox. 4 (87.5%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (75%)

안전 데이터

rtecs
GP1770000
ridadr
2811
HS 번호
2914500090
risk_code
36/37/38-41-22
hazard_code
Xi,Xn
safety_code
26-36/37/39

화학 및 산업

응용 분야

용도It is employed as a intermediate for pharmaceutical.

상·하류 제품 정보

공급사50 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]

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