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에폭시데칸(1.2-)

1,2-Epoxydecane

HCID 16993
새 노트새 반응견적 요청하기
인쇄 미리보기
기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
2404-44-6
표준 SMILES
CCCCCCCCC1CO1
InChIKey
AAMHBRRZYSORSH-UHFFFAOYSA-N
분자식
C10H20O
평균 분자량
156.26 g/mol
단동위원소 질량
156.15141526

개요

1,2-epoxydecane is a clear colorless mobile liquid with a ethereal odor. (NTP, 1992)

이름 및 식별자

우선 이름
1,2-Epoxydecane
IUPAC
2-octyloxirane
현지명
에폭시데칸(1.2-)
영어명
1,2-Epoxydecane
분자식
C10H20O
분자량
156.27

이름 및 동의어

1,2-EPOXYDECANE2404-44-6Oxirane, octyl-Octyloxirane1,2-Decylene OxideOxirane, 2-octyl-1-Decene oxideDTXSID4025242Q312EN88HU1-DECENE EPOXIDENSC-161971,2-DECENE OXIDE
이름 더 보기
에폭시데칸(1.2-)1,2-에폭시데칸1,2-에폭시데케인NSC 16197Vikolox 10OCTYLOXIRANOxirane,decyl1,2-EPOXYDECANDecene epoxide
1,2-DECENE EPOXIDEDECANE, 1,2-EPOXY-DTXCID905242RefChem:1052338219-295-42-OctyloxiraneMFCD00005158CCRIS 2615

데이터베이스 식별자

CAS
2404-44-6、68413-40-1
PubChem CID
16993
DTXSID
DTXSID4025242
ChEMBL
CHEMBL1422466
UNII
Q312EN88HU
EC Number
219-295-4
Nikkaji
J91.336G

물성

구조 계산 물성

XLogP
4.1
극성 표면적
12.5 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
1
회전 가능 결합 수
7
무거운 원자 수
11
형식 전하
0
복잡도
90.9

실험 및 물리화학적 성질

Density0.837 (NTP, 1992) - Less dense than water; will float
Solubilityless than 1 mg/mL at 64 °F (NTP, 1992)
Flash Point173 °F (NTP, 1992)
Boiling Point234 to 235 °F at 35 mmHg (NTP, 1992)
Physical Description1,2-epoxydecane is a clear colorless mobile liquid with a ethereal odor. (NTP, 1992)

물리화학적 성질

끓는 점
94 °C · 94 °C (15 mmHg)
밀도
0.84 · 0.84
굴절률
1.427 · 1.427-1.43
인화점
78 °C · 78 °C
물리적 상태
투명한 액체
색상
무색~연황색
BRN
104132 · 104132
안정성
안정적이지만 습기에 민감합니다. 타기 쉬운. 강산, 강산화제, 부식제, 과산화물과 호환되지 않습니다.
InChI
InChI=1S/C10H20O/c1-2-3-4-5-6-7-8-10-9-11-10/h10H,2-9H2,1H3
InChIKey
AAMHBRRZYSORSH-UHFFFAOYSA-N

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 0.7% (1 of 150) of reports.

Warning

H315 (99.3%): Causes skin irritation [Warning Skin corrosion/irritation]

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 150 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationREACH registered substance: Octyloxirane (EC: 219-295-4)
Fire HazardsThis chemical is flammable. (NTP, 1992)
Health HazardsSYMPTOMS: Symptoms of exposure to this compound may include local irritation of the skin and respiratory tract.
Reactive GroupEpoxides
Reactivity AlertsPolymerizable
Reactivity Profile · 1건

Epoxides, such as 1,2-EPOXYDECANE, are highly reactive. They polymerize in the presence of catalysts or when heated. These polymerization reactions can be violent. Compounds in this group react with acids, bases, and oxidizing and reducing agents. They react, possibly violently with water in the presence of acid and other catalysts. This chemical is incompatible with strong acids, caustics and peroxides. (NTP, 1992)

Air and Water ReactionsSensitive to moisture and heat. Insoluble in water.
Hazard Classes and Categories

화학 및 산업

용도 및 제조

General Manufacturing InformationOxirane, 2-octyl-: ACTIVE

응용 분야

일반 설명Clear colorless mobile liquid with a ethereal odor.

상·하류 제품 정보

상류 원료

2-데카놀1-Decen-3-one트랜스-2-데센-1-OL데센

관련 반응

43건
반응 기록 만들기
HRID 123739 반응식
HRID 123739생성물로Training data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 209204 반응식
HRID 209204반응물로Training data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 267606 반응식
HRID 267606반응물로uspto-grants-1976_03
HRID 267607 반응식
HRID 267607반응물로uspto-grants-1976_03
HRID 283100 반응식
HRID 283100반응물로Training data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 376922 반응식
HRID 376922반응물로uspto-grants-2000_02
HRID 645323 반응식
HRID 645323반응물로uspto-grants-2010_04
HRID 650280 반응식
HRID 650280생성물로uspto-grants-2001_08
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SMILES
O1CC1CCCCCCCC
LogP
3.81 at · 3.81 at 25℃
EPA
1 · 1,2-Epoxydecane (2404-44-6)

화학적 성질

colourless mobile liquid with an ether-like odour

Skin Irrit. 2 (99.3%)

안전 및 보호

Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid · 1건

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

Nonfire Spill Response · 1건

SMALL SPILLS AND LEAKAGE: If you spill this chemical, FIRST REMOVE ALL SOURCES OF IGNITION. Then, use absorbent paper to pick up all liquid spill material. Your contaminated clothing and absorbent paper should be sealed in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with ethanol followed by washing with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Personal Protective Equipment (PPE) · 1건

RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)

안전 데이터

tsca
TSCA listed
HS 번호
29109000
risk_code
36/37/38
hazard_code
Xi
safety_code
37/39-26-36/37/39