N-(pyridin-2-ylmethyl)ethanamine

HCID 4723804CAS 51639-58-8

기본 정보

표준 SMILES: CCNCc1ccccn1
InChIKey: BQSUUGOCTJVJIF-UHFFFAOYSA-N
분자식: C8H12N2
평균 분자량: 136.19 g/mol
단동위원소 질량: 136.10004838

이름 및 식별자

우선 이름: N-(pyridin-2-ylmethyl)ethanamine
IUPAC: N-(pyridin-2-ylmethyl)ethanamine
영어명: CHEMBRDG-BB 9070750
분자식: C8H12N2
분자량: 136.19

이름 및 동의어

51639-58-8N-(pyridin-2-ylmethyl)ethanamineDTXSID00406028RefChem:1091466DTXCID30356880N-Ethyl-N-(2-pyridylmethyl)amineN-(2-PYRIDINYLMETHYL)ETHANAMINEMFCD07411568ethyl(pyridin-2-ylmethyl)amine2-Pyridinemethanamine, N-ethyl-ethyl[(pyridin-2-yl)methyl]amineethyl-pyridin-2-ylmethyl-amine

이름 더 보기

AKOS ISYA00851AKOS LT-1125X501CHEMBRDG-BB 9070750N-(Pyridin-2-ylmethyl)UKRORGSYN-BB BBV-040220N-ethyl-2-PyridineMethanaMine

STK511427SB52299CS-0151964EN300-102696_x000D_N-Ethyl-N-(2-pyridylmethyl)amineA21962N-Ethyl-2-pyridylmethylamineN-(2-Pyridinylmethyl)ethanam

데이터베이스 식별자

CAS: 51639-58-8
PubChem CID: 4723804
DTXSID: DTXSID00406028
EC Number: 172-465-9

물성

구조 계산 물성

XLogP: 0.7
극성 표면적: 24.9 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 3
무거운 원자 수: 10
형식 전하: 0
복잡도: 83.3

물리화학적 성질

저장 조건: Keep in dark place,Inert atmosphere,Room temperature
물리적 상태: solid
InChI: 1S/C8H12N2/c1-2-9-7-8-5-3-4-6-10-8/h3-6,9H,2,7H2,1H3
InChIKey: BQSUUGOCTJVJIF-UHFFFAOYSA-N
SMILES: CCNCC1=NC=CC=C1

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P330, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.