2-메틸알릴아민

2-Methylallylamine

HCID 76141CAS 2878-14-0

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: C=C(C)CN
InChIKey: VXDHQYLFEYUMFY-UHFFFAOYSA-N
분자식: C4H9N
평균 분자량: 71.12 g/mol
단동위원소 질량: 71.07349929

이름 및 식별자

우선 이름: 2-Methylallylamine
IUPAC: 2-methylprop-2-en-1-amine
현지명: 2-메틸알릴아민
영어명: 2-Methylallylamine
분자식: C4H9N
분자량: 71.12

이름 및 동의어

2-Methylallylamine2878-14-02-Methylprop-2-en-1-ylamineFHJ35WE6DGEINECS 220-724-2NSC-32610(2-METHYLALLYL)AMINEDTXSID80182954NSC 32610RefChem:475939DTXCID20105445220-724-2

이름 더 보기

2-메틸알릴아민AKOS 91389JACS-2878-14-02-Methylallylamine>2-Methylallylamine 98%2-Methylallylamine,97%2-Methyl allyl aMine HCl2-methylallylamine, 98 %

2-methylprop-2-en-1-amineMethallylamineMFCD000536462-Propen-1-amine, 2-methyl-2-Propen-1-amine, 2-methyl- (9CI)UNII-FHJ35WE6DG3-Amino-2-methyl-1-propeneCH2=C(CH3)CH2NH2

데이터베이스 식별자

CAS: 2878-14-0
PubChem CID: 76141
DTXSID: DTXSID80182954
UNII: FHJ35WE6DG
EC Number: 220-724-2
Nikkaji: J306.799H

물성

구조 계산 물성

XLogP: 0.6
극성 표면적: 26 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 1
회전 가능 결합 수: 1
무거운 원자 수: 5
형식 전하: 0
복잡도: 38.9

물리화학적 성질

끓는 점: 78 °C · 78 °C
밀도: 0.78 · 0.78
굴절률: 1.429 · 1.429-1.432
인화점: -28 °C · -28 °C
저장 조건: 0 · 0-6°C
물리적 상태: 액체
산도 계수 (pKa): 9.45 · 9.45±0.29(Predicted)
색상: 무색의
InChI: InChI=1S/C4H9N/c1-4(2)3-5/h1,3,5H2,2H3
InChIKey: VXDHQYLFEYUMFY-UHFFFAOYSA-N
SMILES: C(N)C(C)=C
NIST: 2 · 2-Propen-1-amine, 2-methyl-(2878-14-0)

화학적 성질

clear colorless liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H225 (83.3%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 6 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesFlam. Liq. 2 (83.3%)

안전 데이터

wgk: 3
ridadr: 1992
HS 번호: 29211990
risk_code: 36/37/38-11-36-22
hazard_code: Xi-F,F,Xi,C,Xn
safety_code: 37/39-26-16
포장분류: II
위험 등급: FLAMMABLE, CORROSIVE
위험 참고 사항: Highly Flammable/Irritant
Hazard Classifications: Acute Tox. 4 OralEye Irrit. 2
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

응용 분야 · 1건

용도2-Methylallylamine is an intermediate used in the synthesis of urea-containing FK506 binding protein inhibitors. It is also used to prepare benzothiazepine dioxides with HIV-1 protease inhibitory activities. It is dehydrogenated to methacrylonitrile over a silver catalyst. Copolymerization of methallylamine with acrylonitrile increases the affinity of polyacrylonitrile fibers for dyes.