Benzenemethanol, 2,6-dichloro-

(2,6-Dichlorophenyl)methanol · ZERENEX E/4047846 · TIMTEC-BB SBB008039 · RARECHEM AL BD 0021 · Carnosine Impurity 8 · 2,6-dichlorobenzylol · Miconazole Impurity 16 · 2,6-dichloro-benzylalcoho

https://huagongshe.com/ko/chemical/27156

식별자 및 물리적 특성

CAS No.	15258-73-8
분자식	C7H6Cl2O
평균 분자량	177.02 g/mol
단동위원소 질량	175.9795702 g/mol
SMILES	OCc1c(Cl)cccc1Cl
InChIKey	WKKHCCZLKYKUDN-UHFFFAOYSA-N
PubChem CID	27156
EC No.	239-300-3
DTXSID	DTXSID30165075

화학 및 물리적 성질

XLogP	2.3
극성 표면적	20.2
수소 결합 공여자 수	1
수소 결합 수용자 수	1
회전 가능 결합 수	1
무거운 원자 수	10
형식 전하	0
복잡도	97
녹는점	96-98 °C(lit.)
끓는 점	150°C 25mm
밀도	1.2970 (rough estimate)
굴절률	1.5570 (estimate)
인화점	150°C/25mm
저장 조건	Sealed in dry,Room Temperature
용해도	클로로포름(약간 용해됨), DMSO(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태	고체
pKa(산도 계수)	13.57±0.10(Predicted)
색상	흰색에서 황백색까지
BRN	1938356
InChI	1S/C7H6Cl2O/c8-6-2-1-3-7(9)5(6)4-10/h1-3,10H,4H2
InChIKey	WKKHCCZLKYKUDN-UHFFFAOYSA-N
SMILES	OCc1c(Cl)cccc1Cl
NIST	2,6-Dichlorobenzyl alcohol(15258-73-8)

화학적 성질

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안전 및 규제

GHS 분류	WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory 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 5 reports by companies from 2 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.
규제 정보	Chemical: Benzenemethanol, 2,6-dichloro-Benzenemethanol, 2,6-dichloro-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and Categories	Skin Irrit. 2 (100%)Eye Irrit. 2A (100%)STOT SE 3 (100%)
수질 위해 등급(WGK)	3
RTECS 번호	DO0900000
관세 코드	29062990
위험 표시	Xi
안전 문구(S)	24/25
위험 참고 사항	Irritant
저장 분류	11 - Combustible Solids

용도

2,6-Dichlorobenzyl Alcohol is a useful reagent in organic synthesis.