9-Octadecenoic Acid

HCID 965CAS 2027-47-6

기본 정보

표준 SMILES: CCCCCCCCC=CCCCCCCCC(=O)O
InChIKey: ZQPPMHVWECSIRJ-UHFFFAOYSA-N
분자식: C18H34O2
평균 분자량: 282.5 g/mol
단동위원소 질량: 282.25588033

개요

octadec-9-enoic acid has been reported in Pongamia pinnata var. pinnata, Arisaema tortuosum, and other organisms with data available.

이름 및 식별자

우선 이름: 9-Octadecenoic Acid
IUPAC: octadec-9-enoic acid

이름 및 동의어

9-octadecenoic acidOctadec-9-enoic acid2027-47-6DTXSID7048118CHEBI:36021RefChem:1075027DTXCID4028090217-977-6odorlessMangroven-Octadec-9-ensaureOleic acid-ul-13C18

이름 더 보기

Oleic acid-9,10-d2NCIMech_000314SCHEMBL1139NCIOpen2_008144Oleic Acid_GurudeebanSatyavaniorb1222857SCHEMBL6344575287100-82-7

데이터베이스 식별자

CAS: 2027-47-6、287100-82-7
PubChem CID: 965
DTXSID: DTXSID7048118
EC Number: 217-977-6、806-406-1

물성

구조 계산 물성

XLogP: 6.5
극성 표면적: 37.3 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 15
무거운 원자 수: 20
형식 전하: 0
복잡도: 234

실험 및 물리화학적 성질

Endocrine DisruptorsPotential endocrine disrupting compound

안전 및 규제

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for 100% (104 of 104) of all reports.

Not Classified

Aggregated GHS information provided per 104 reports by companies from 1 notifications to the ECHA C&L Inventory.

Warning

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

P264, P280, P302+P352, P321, P332+P317, and P362+P364 (click each P-code to see the statement)

유해성 정보

Regulatory Information9-Octadecenoic acid: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazard Classes and Categories · 2건

Skin Irrit. 2 (100%)

Not Classified