1-Bromo-2-methyl-1-propene

1-Bromo-2-methylprop-1-ene · 1-BROMO-2-METHYL-1-PROPENE · 2-methyl-1-propenylbromide · Isocrtyl bromide · 1-Bromoisobutene · 1-Bromo-2-methyL · ISOCROTYL BROMIDE · (Z)-1-Bromo-2-butene

https://huagongshe.com/ko/chemical/98560

식별자 및 물리적 특성

CAS No.	3017-69-4
분자식	C4H7Br
평균 분자량	135 g/mol
단동위원소 질량	133.97311232 g/mol
SMILES	CC(C)=CBr
InChIKey	DEFNUDNHTUZJAL-UHFFFAOYSA-N
PubChem CID	98560
ChEMBL	CHEMBL157418
EC No.	629-499-9
DTXSID	DTXSID40184252

화학 및 물리적 성질

XLogP	2.4
극성 표면적	0
수소 결합 공여자 수	0
수소 결합 수용자 수	0
회전 가능 결합 수	0
무거운 원자 수	5
형식 전하	0
복잡도	41.6
SpringerMaterials Properties	Boiling point
녹는점	-115.07°C (estimate)
끓는 점	92 °C (lit.)
밀도	1.318 g/mL at 25 °C (lit.)
굴절률	n20/D 1.462(lit.)
인화점	46 °F
저장 조건	2-8°C
물리적 상태	liquid
BRN	1733844
InChI	InChI=1S/C4H7Br/c1-4(2)3-5/h3H,1-2H3
InChIKey	DEFNUDNHTUZJAL-UHFFFAOYSA-N
SMILES	C(/Br)=C(\C)/C

안전 및 규제

GHS 분류	DangerH225 (100%): 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 42 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard Classes and Categories	Flam. Liq. 2 (100%)
수질 위해 등급(WGK)	3
운송 번호(UN)	UN 1993 3/PG 2
위험 문구(R)	11-36/37/38
위험 표시	F,Xi
안전 문구(S)	16-26-33
포장분류	II
위험 등급	3.1Eye Irrit. 2Flam. Liq. 2Skin Irrit. 2STOT SE 3
F 고인화성물질	8-19
저장 분류	3 - Flammable liquids

용도

1-Bromo-2-methyl-1-propene has been used in:preparation of esters of 2,4-dienoic acids via palladium catalyzed reaction with methyl acrylate in the presence of triethylaminetotal synthesis of ocular age pigment, A2-Esynthesis of 3-nor-geraniol [2H2]