1-브로모옥타데칸

1-Bromooctadecane

HCID 8218CAS 112-89-0

기본 정보

표준 SMILES
CCCCCCCCCCCCCCCCCCBr
InChIKey
WSULSMOGMLRGKU-UHFFFAOYSA-N
분자식
C18H37Br
평균 분자량
333.4 g/mol
단동위원소 질량
332.20786328

개요

1-Bromooctadecane has been reported in Vernonanthura patens with data available.

이름 및 식별자

우선 이름
1-Bromooctadecane
IUPAC
1-bromooctadecane
현지명
1-브로모옥타데칸
영어명
1-Bromooctadecane
분자식
C18H37Br
분자량
333.39

이름 및 동의어

1-BROMOOCTADECANEOctadecyl bromideOctadecane, 1-bromo-AI3-00994NSC 5542EINECS 204-013-4OCTADECANE,1-BROMODTXSID8059423nOctadecyl bromideOctadecane, 1bromoRefChem:75174DTXCID4033265
이름 더 보기
1-브로모옥타데칸BroMo octadecaneOCLadecyl BroMide1-bromo-octadecan1-Bromooctodecaneoctadecane,1-bromo-1-Bromooctadecane,96%
204-013-4InChI=1/C18H37Br/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h2-18H2,1HWSULSMOGMLRGKU-UHFFFAOYSA-N112-89-0Stearyl bromiden-Octadecyl bromideC18H37Brbromooctadecane

데이터베이스 식별자

CAS
112-89-0
PubChem CID
8218
DTXSID
DTXSID8059423
UNII
Z7M35JLL5U
EC Number
204-013-4
Nikkaji
J379D

물성

구조 계산 물성

XLogP
10.3
극성 표면적
0 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
0
회전 가능 결합 수
16
무거운 원자 수
19

실험 및 물리화학적 성질

Chemical ClassesOther Classes -> Halogenated Aliphatics, Saturated
Vapor Pressure0.00000594 [mmHg]
Physical DescriptionWhite odorless solid; mp = 25-30 deg C; [Alfa Aesar MSDS]

물리화학적 성질

녹는점
25 · 25-30 °C(lit.)
끓는 점
214 · 214-216 °C12 mm Hg(lit.)
밀도
0.976 g/mL · 0.976 g/mL at 25 °C(lit.)
굴절률
1.462 · 1.462-1.464
인화점
230 °F · >230 °F
저장 조건
Inert atmosphere,Room Temperature

화학적 성질

It is a colorless or light yellow liquid, soluble in ethanol, ether, ethyl acetate, and petroleum ether, but insoluble in water. It decomposes when exposed to light and is used in organic synthesis.

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 0.8% (1 of 127) of reports.

Warning

H315 (98.4%): Causes skin irritation [Warning Skin corrosion/irritation]

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)

Aggregated GHS information provided per 127 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 2건

Status: Active Update: 11-09-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/20869

Octadecane, 1-bromo-: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummaryMay cause irritation; [Alfa Aesar MSDS] See Lauryl bromide.
Hazard Classes and CategoriesSkin Irrit. 2 (98.4%)

안전 데이터

wgk
3
tsca
TSCA listed
HS 번호
29033036
risk_code
36/37/38
safety_code
22-24/25
기존화학 물질
KE-03694

화학 및 산업

용도 및 제조

General Manufacturing InformationOctadecane, 1-bromo-: ACTIVE
응용 분야 · 1건

용도1-Bromooctadecane was used in the synthesis of shortened single-walled carbon nanotubes (s-SWCNTs). It is utilized to prepare octadecane in the presence of sodium borohydride as a catalyst. It is involved as a raw material for the preparation of dimethyldistearylammonium bromide, which is a bentonite modifier.

제조 방법 · 1건

1-Bromooctadecane is synthesized by the reaction of stearyl alcohol with hydrogen bromide. The alcohol is heated to 100°C, dry hydrogen bromide is introduced, and the reaction temperature is maintained at 100-120°C until the solution no longer absorbs hydrogen bromide. The bromide is layered, the organic phase is washed with concentrated sulfuric acid, the bromide after the acid solution is separated and mixed with an equal volume of 90% methanol, washed with ammonia to make the bromide alkaline, then washed with 90% methanol, and anhydrous Dry calcium chloride. Finally, vacuum distillation, collecting 209-211 ℃ (1.33kPa) fraction is 1-bromooctadecane, and the yield is 90%.

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
爱斯特(成都)生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
科瑞迪化学400-821-5857 021-64326257 · [email protected]

관련 반응

130건

연결된 노트

불러오는 중…