p-(페닐티오)벤질알코올

p-(Phenylthio)benzyl alcohol

HCID 80593CAS 6317-56-2

기본 정보

표준 SMILES
OCc1ccc(Sc2ccccc2)cc1
InChIKey
PGOAWMRWDZJQTB-UHFFFAOYSA-N
분자식
C13H12OS
평균 분자량
216.3 g/mol
단동위원소 질량
216.06088618

이름 및 식별자

우선 이름
p-(Phenylthio)benzyl alcohol
IUPAC
(4-phenylsulfanylphenyl)methanol
현지명
p-(페닐티오)벤질알코올
영어명
p-(phenylthio)benzyl alcohol
분자식
C13H12OS
분자량
216.3

이름 및 동의어

6317-56-2p-(Phenylthio)benzyl alcohol4-(Phenylthio)benzyl Alcohol4-(Phenylthio)benzenemethanolbenzenemethanol, 4-(phenylthio)-[4-(phenylsulfanyl)phenyl]methanolNSC 43060TMD9BW7WU5EINECS 228-658-6NSC-43060DTXSID10212511(4-(PHENYLSULFANYL)PHENYL)METHANOL
이름 더 보기
p-(페닐티오)벤질알코올(4-(Phenylthio)4-(Phenylthio)Benzyl Chlorideparabenzenethioylbenzenemethylol(4-(chloromethyl)phenyl)(phenyl)sulfane
RefChem:169268DTXCID40135002228-658-6(4-(phenylthio)phenyl)methanol(4-phenylsulfanylphenyl)methanolMFCD04108413[4-(phenylthio)phenyl]methanolNSC43060

데이터베이스 식별자

CAS
6317-56-2
PubChem CID
80593
DTXSID
DTXSID10212511
UNII
TMD9BW7WU5
EC Number
228-658-6
Nikkaji
J206.909A

물성

구조 계산 물성

XLogP
3.1
극성 표면적
45.5 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
2
회전 가능 결합 수
3
무거운 원자 수
15

물리화학적 성질

녹는점
46 · 46-48°C
끓는 점
390.2 · 390.2±25.0 °C(Predicted)
밀도
1.21 · 1.21±0.1 g/cm3(Predicted)
저장 조건
-20 °C · Sealed in dry,Store in freezer, under -20°C
용해도
DMSO(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태
고체

화학적 성질

Pale Beige Solid

안전 및 규제

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for 66.7% (2 of 3) of all reports.

Warning

H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (33.3%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (33.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (33.3%): 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 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 2 of 3 reports by companies.;There is 1 notification provided by 1 of 3 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.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (33.3%);Skin Irrit. 2 (33.3%);Eye Irrit. 2A (33.3%);STOT SE 3 (33.3%)

안전 데이터

신호 어
Warning
유해·위험 문구
암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드 H302

화학 및 산업

응용 분야

용도An impurity of Fenticonazole nitrate (F279250), a new potent antimycotic compound.

공급사50 곳

Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
湖北科乐精细化工有限公司027-59101668 19945030958 · [email protected]

관련 반응

2건

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