이소노닐페놀

2-Isononylphenol

HCID 119757CAS 11066-49-2

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CC(C)CCCCCCc1ccccc1O
InChIKey: UZVAZDQMPUOHKP-UHFFFAOYSA-N
분자식: C15H24O
평균 분자량: 220.35 g/mol
단동위원소 질량: 220.18271539

이름 및 식별자

우선 이름: 2-Isononylphenol
IUPAC: 2-(7-methyloctyl)phenol
현지명: 이소노닐페놀
영어명: isononylphenol
분자식: C15H24O
분자량: 220.35046

이름 및 동의어

o-Isononylphenol27938-31-42-IsononylphenolRefChem:473854248-741-0Isononylphenol2-(7-methyloctyl)phenol11066-49-22169371-45-1Phenol, 2-isononyl-isononyl phenolSCHEMBL223105

이름 더 보기

이소노닐페놀isononyl-phenoEinecs 234-284-4Phenol, isononyl-

SCHEMBL7949910SCHEMBL30211835DTXSID90950626EINECS 248-741-0MFCD30533811AS-79015NS00050538D93052

데이터베이스 식별자

CAS: 11066-49-2、27938-31-4
PubChem CID: 119757
DTXSID: DTXSID90950626
EC Number: 234-284-4、248-741-0
Nikkaji: J3.715.743K

물성

구조 계산 물성

XLogP: 5.9
극성 표면적: 20.2 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 1
회전 가능 결합 수: 7
무거운 원자 수: 16
형식 전하: 0
복잡도: 165

물리화학적 성질

용해도: Chloroform (Slightly), Methanol (Slightly), DCM, Hexanes
물리적 상태: 기름
색상: Light Yellow to Colourless
EPA: Isononylphenol (11066-49-2)

안전 및 규제

GHS 분류

GHS Classification · 6건

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H318 (80.9%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H361 (100%): Suspected of damaging fertility or the unborn child [Warning Reproductive toxicity]；H400 (80.9%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]；H410 (100%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]

P203, P260, P264, P264+P265, P270, P273, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P318, P321, P330, P363, P391, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 68 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Regulatory Information · 2건

Hazard Traits - Endocrine Toxicity；Authoritative List - EC EDs；Report - if used as a fragrance or flavor ingredient

Substance: Isononylphenol；EC: 234-284-4；Date of inclusion: >19-Dec-2012；Reason for inclusion: Endocrine disrupting properties (Article 57(f) - environment)

Hazard Classes and Categories · 2건

Acute Tox. 4 (100%)；Skin Corr. 1B (100%)；Eye Dam. 1 (80.9%)；Repr. 2 (100%)；Aquatic Acute 1 (80.9%)；Aquatic Chronic 1 (100%)

Aquatic Acute 1 (100%)；Aquatic Chronic 1 (100%)

규제 정보