테트라데켄-1-산화물

테트라데켄-1-산화물 · 2-Dodecyloxirane · dodecyl-oxiran · dodecyl-Oxirane · 2-lauryloxirane · n-dodecyloxirane · EPOXY TETRADECANE · Oxirane, dodecyl-

https://huagongshe.com/ko/chemical/18604

식별자 및 물리적 특성

CAS No.	3234-28-4
분자식	C14H28O
평균 분자량	212.37 g/mol
단동위원소 질량	212.21401551 g/mol
SMILES	CCCCCCCCCCCCC1CO1
InChIKey	IOHJQSFEAYDZGF-UHFFFAOYSA-N
PubChem CID	18604
ChEMBL	CHEMBL1598368
EC No.	221-781-6
DTXSID	DTXSID9025249
현지명	테트라데켄-1-산화물

화학 및 물리적 성질

XLogP	6.3
극성 표면적	12.5
수소 결합 공여자 수	0
수소 결합 수용자 수	1
회전 가능 결합 수	11
무거운 원자 수	15
형식 전하	0
복잡도	133
밀도	0.847 (NTP, 1992) - Less dense than waterwill float0.845 g/mL at 25 °C (lit.)
용해도	less than 1 mg/mL at 68 °F (NTP, 1992)
인화점	greater than 235 °F (NTP, 1992)>110°C
끓는 점	203 to 205 °F at 0.4 mmHg (NTP, 1992)95-96 °C/0.4 mmHg (lit.)
녹는점	less than 68 °F (NTP, 1992)185-186 °C (decomp)
Physical Description	1,2-epoxytetradecane is a clear colorless mobile liquid with an ether-like odor. (NTP, 1992)
증기압	0.176Pa at 25℃
굴절률	1.4408
물리적 상태	liquid
비중	0.845
용해도	130μg/L at 20℃
BRN	107525
InChI	InChI=1S/C14H28O/c1-2-3-4-5-6-7-8-9-10-11-12-14-13-15-14/h14H,2-13H2,1H3
InChIKey	IOHJQSFEAYDZGF-UHFFFAOYSA-N
SMILES	O1CC1CCCCCCCCCCCC
LogP(분배 계수)	5.77 at 25℃
EPA	1,2-Epoxytetradecane (3234-28-4)

안전 및 규제

건강 유해성
GHS 분류	This chemical does not meet GHS hazard criteria for 2.9% (5 of 175) of reports.WarningH315 (97.1%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (26.9%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (24%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]H400 (70.3%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]H410 (70.3%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 175 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Reported as not meeting GHS hazard criteria per 5 of 175 reports by companies.There are 9 notifications provided by 170 of 175 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.
규제 정보	Chemical: Oxirane, dodecyl-Oxirane, 2-dodecyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Oxirane, 2-dodecyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)Status: Active Update: 15-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/11734Oxirane, dodecyl-: Does not have an individual approval but may be used under an appropriate group standard
기타 안전 정보	IMAP assessments - Long-chain alkyl oxiranes: Human health tier II assessment
화재 위험	This chemical is probably combustible. (NTP, 1992)

용도

1,2-Epoxytetradecane is used in the preparation of polymeric prodrugs used in treatments of cancer.

일반 설명

Clear colorless mobile liquid with an ether-like odor.