2-Phenylpropionic acid, (-)-

HCID 446626CAS 7782-26-5

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: C[C@@H](C(=O)O)c1ccccc1
InChIKey: YPGCWEMNNLXISK-SSDOTTSWSA-N
분자식: C9H10O2
평균 분자량: 150.17 g/mol
단동위원소 질량: 150.06807956

개요

(R)-hydratropic acid is the (R)-enantiomer of hydratropic acid. It is an enantiomer of a (S)-hydratropic acid.

이름 및 식별자

우선 이름: 2-Phenylpropionic acid, (-)-
IUPAC: (2R)-2-phenylpropanoic acid

이름 및 동의어

7782-26-5(2R)-2-phenylpropanoic acid3YF5O2136LL-PPAHYDRATROPIC ACID, (R)-(-)-2-PHENYLPROPIONIC ACID, (-)-(-)-2-phenylpropionic acid(-)-(R)-2-PHENYLPROPIONIC ACID(-)-2-PHENYLPROPANOIC ACIDNSC-245032(R)-.ALPHA.-METHYLPHENYLACETIC ACIDRefChem:478222

이름 더 보기

(r)-alpha-methylphenylacetic acid624-115-6(R)-2-phenylpropanoic acid(R)-(-)-2-Phenylpropionic acid(R)-hydratropic acid(-)-hydratropic acidMFCD00063140R-2-PHENYL-PROPRIONIC ACID

데이터베이스 식별자

CAS: 7782-26-5
PubChem CID: 446626
DTXSID: DTXSID30228437
ChEBI: CHEBI:43035
UNII: 3YF5O2136L
EC Number: 624-115-6
Nikkaji: J61.973F

물성

구조 계산 물성

XLogP: 1.9
극성 표면적: 37.3 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 2
무거운 원자 수: 11
형식 전하: 0
복잡도: 136

실험 및 물리화학적 성질

SpringerMaterials PropertiesOptical coefficient

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 46 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.