2-Pyridineacetic acid, hydrochloride (1:1)

HCID 85317CAS 16179-97-8

기본 정보

표준 SMILES: Cl.O=C(O)Cc1ccccn1
InChIKey: MQVISALTZUNQSK-UHFFFAOYSA-N
분자식: C7H8ClNO2
평균 분자량: 173.6 g/mol
단동위원소 질량: 173.02435618

이름 및 식별자

우선 이름: 2-Pyridineacetic acid, hydrochloride (1:1)
IUPAC: 2-pyridin-2-ylacetic acid;hydrochloride

이름 및 동의어

16179-97-82-Pyridylacetic acid hydrochloride2-Pyridineacetic acid hydrochloride2-Pyridineacetic acid, hydrochloride2-Pyridineacetic acid, hydrochloride (1:1)EINECS 240-316-8NSC 83227DTXSID70884874RefChem:89350DTXCID2010242952-(Pyridin-2-Yl)Acetic Acid Hydrochloridepyridin-2-ylacetic acid hydrochloride

이름 더 보기

MFCD000128122-pyridylacetic acid HCl2-Carboxymethylpyridinium chloride(pyridin-2-yl)acetic acid hydrochloride2'-Pyridylacetic Acid HydrochlorideNSC-832277YM2824V242-pyridin-2-ylacetic acid;hydrochloride

데이터베이스 식별자

CAS: 16179-97-8
PubChem CID: 85317
DTXSID: DTXSID70884874
UNII: 7YM2824V24
EC Number: 240-316-8

물성

구조 계산 물성

극성 표면적: 50.2 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 3
회전 가능 결합 수: 2
무거운 원자 수: 11
형식 전하: 0
복잡도: 125

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 50 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.