1-피리딘-3-일-에틸아민

1-(Pyridin-3-yl)ethan-1-amine

HCID 2771688

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 56129-55-6
표준 SMILES: CC(N)c1cccnc1
InChIKey: IQVQNBXPYJGNEA-UHFFFAOYSA-N
분자식: C7H10N2
평균 분자량: 122.17 g/mol
단동위원소 질량: 122.08439832

이름 및 식별자

우선 이름: 1-(Pyridin-3-yl)ethan-1-amine
IUPAC: 1-pyridin-3-ylethanamine
현지명: 1-피리딘-3-일-에틸아민
영어명: 1-Pyridin-3-yl-ethylamine
분자식: C7H10N2
분자량: 122.17

이름 및 동의어

1-(PYRIDIN-3-YL)ETHAN-1-AMINEDTXSID60971500alpha-methyl-3-pyridinemethanamineRefChem:428555DTXCID60870463679-483-01-Pyridin-3-yl-ethylamine56129-55-61-(pyridin-3-yl)ethanamine1-(3-Pyridyl)ethylamine1-pyridin-3-ylethanamine3-(1-Aminoethyl)pyridine

이름 더 보기

1-피리딘-3-일-에틸아민1-(3-pyridinyl)ethanamine1-(3-Pyridyl)ethylamine, 96%α-Methyl-3-pyridinemethanamine3-PyridineMethanaMine, a-Methyl-3-Pyridinemethanamine, α-methyl-

MFCD01691641BRN 0110124alpha-Methyl-3-pyridinemethylamine3-Pyridinemethylamine, alpha-methyl-1-(pyridin-3-yl)ethanarninerac-1-pyridine-3-yl-ethylamineHMS1748H115-22-09-00392 (Beilstein Handbook Reference)

데이터베이스 식별자

CAS: 56129-55-6
PubChem CID: 2771688
DTXSID: DTXSID60971500
EC Number: 679-483-0

물성

구조 계산 물성

XLogP: 0.1
극성 표면적: 38.9 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 1
무거운 원자 수: 9
형식 전하: 0
복잡도: 83

물리화학적 성질

녹는점: 63 °C · 63 °C
끓는 점: 118 · 118-120 °C(Press: 14 Torr)
밀도: 1.014 g/cm3 · 1.014 g/cm3(Temp: 25 °C)
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
산도 계수 (pKa): 8.81 · 8.81±0.29(Predicted)
물리적 상태: 액체
색상: 무색
InChI: 1S/C7H10N2/c1-6(8)7-3-2-4-9-5-7/h2-6H,8H2,1H3
InChIKey: IQVQNBXPYJGNEA-UHFFFAOYSA-N
SMILES: NC(C)c1cnccc1

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H301 (83%): Toxic if swallowed [Danger Acute toxicity, oral]

P260, P261, P264, P264+P265, P270, P272, P280, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P333+P317, P362+P364, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 47 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 3 (83%)

안전 데이터

wgk: 3
ridadr: UN2735
HS 번호: 2933399990
risk_code: 25-41-43-37/38
hazard_code: T,Xi
safety_code: 26-36/37/39-45-39
포장분류: III
위험 등급: 8
Hazard Classifications: Acute Tox. 3 OralEye Dam. 1Skin Sens. 1
스토리지 클래스: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects