1-Bromo-2-methylbutane, (+)-

HCID 5464167

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 534-00-9
표준 SMILES: CC[C@H](C)CBr
InChIKey: XKVLZBNEPALHIO-YFKPBYRVSA-N
분자식: C5H11Br
평균 분자량: 151.04 g/mol
단동위원소 질량: 150.00441245

이름 및 식별자

우선 이름: 1-Bromo-2-methylbutane, (+)-
IUPAC: (2S)-1-bromo-2-methylbutane
영어명: (S)-1-Bromo-2-methylbutane
분자식: C5H11Br
분자량: 151.04

이름 및 동의어

(S)-1-Bromo-2-methylbutane534-00-9d-Amyl bromide(2S)-1-bromo-2-methylbutaneButane, 1-bromo-2-methyl-, (2S)-CGS982PBTWEINECS 208-583-51-BROMO-2-METHYLBUTANE, (+)-1-BROMO-2-METHYLBUTANE, (2S)-(2S)-1-BROMO-2-METHYLBUTANE [MI]RefChem:430314(S)-(+)-1-Bromo-2-methylbutane

이름 더 보기

(s)-butand-Amylbromideactiveamylbromide1-Brom-2-methylbutan(S)-l-1-bromo-2-methylbutane(S)-2-Methyl-1-bromobutane(+)-2-Methyl-1-bromobutane(S)(+)-2-METHYLBUTYLBROMIDE

UNII-CGS982PBTWMFCD00078662(S)-(+)-2-Methyl-1-bromobutane(+)-1-Bromo-2-methylbutane(2S)-1-bromo-2-methyl-butaneButane, 1-bromo-2-methyl-, (S)-(S)?-?(+)?-?1-?Bromo-?2-?methylbutane(+)-2-Methylbutyl bromide

데이터베이스 식별자

CAS: 534-00-9
PubChem CID: 5464167
DTXSID: DTXSID70878758
UNII: CGS982PBTW
EC Number: 208-583-5
Nikkaji: J57.176H

물성

구조 계산 물성

XLogP: 2.7
극성 표면적: 0 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 0
회전 가능 결합 수: 2
무거운 원자 수: 6
형식 전하: 0
복잡도: 27.1

실험 및 물리화학적 성질

SpringerMaterials PropertiesDensity

물리화학적 성질

녹는점: -105.4 °C · -105.4°C (estimate)
끓는 점: 121 · 121-122 °C(lit.)
밀도: 1.223 g/mL · 1.223 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.445(lit.)
인화점: 72 °F · 72 °F
저장 조건: Store at room temperature
용해도: soluble in Acetone, Chloroform, Dichloromethane, Diethyl Ether
물리적 상태: 기름
색상: 무색의
수용성: 물에 불용성.
Merck: 13 · 13,605
BRN: 1718815 · 1718815
InChI: 1S/C5H11Br/c1-3-5(2)4-6/h5H,3-4H2,1-2H3/t5-/m0/s1
InChIKey: XKVLZBNEPALHIO-YFKPBYRVSA-N
SMILES: CC[C@H](C)CBr
NIST: 1 · Butane, 1-bromo-2-methyl-, (S)-(534-00-9)
EPA: 1 · Butane, 1-bromo-2-methyl-, (2S)- (534-00-9)

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H225 (91.1%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 45 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationButane, 1-bromo-2-methyl-, (2S)-: 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 CategoriesFlam. Liq. 2 (91.1%)

안전 데이터

wgk: 3
tsca: TSCA listed
ridadr: UN 1993 3/PG 2
risk_code: 10-36/37/38
hazard_code: Xi
safety_code: 26-36
포장분류: II
위험 등급: 3.1
Hazard Classifications: Eye Irrit. 2Flam. Liq. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 3 - Flammable liquids

화학 및 산업

용도 및 제조

General Manufacturing InformationButane, 1-bromo-2-methyl-, (2S)-: INACTIVE

응용 분야

용도(S)-(+)-1-Bromo-2-methylbutane, is used for the synthesis of chiral nematic liquid crystals and optically active Grignard reagents.

상·하류 제품 정보

하류 제품

(S)-(+)-5-METHYL-1-헵탄올 DIETHYLMETHYL(2-METHYLBUTYL)말로네이트 4-[(2S)-2-메틸부틸]-1,1'-비페닐

공급사49 곳

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

苏州申拓医药科技有限公司13911244683 18151949202

杭州品高化工有限公司0571-87658025 · [email protected]

石家庄衍晟生物科技有限公司18332018567; 18332018567 · [email protected]

阿法埃莎（中国）化学有限公司400-6106006 · [email protected]

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