4-Methoxyphenoxyacetic acid

HCID 74649CAS 1877-75-4

기본 정보

표준 SMILES
COc1ccc(OCC(=O)O)cc1
InChIKey
BHFSBJHPPFJCOS-UHFFFAOYSA-N
분자식
C9H10O4
평균 분자량
182.17 g/mol
단동위원소 질량
182.0579088

이름 및 식별자

우선 이름
4-Methoxyphenoxyacetic acid
IUPAC
2-(4-methoxyphenoxy)acetic acid
영어명
4-Methoxyphenoxyacetic acid
분자식
C9H10O4
분자량
182.17

이름 및 동의어

2-(4-Methoxyphenoxy)acetic acid1877-75-44-Methoxyphenoxyacetic acidAcetic acid, (4-methoxyphenoxy)-(p-Methoxyphenoxy)acetic acidNSC 4255EINECS 217-513-2NSC 45652Acetic acid, 2-(4-methoxyphenoxy)-AI3-10592DTXSID2062030RefChem:99662
이름 더 보기
AKOS BB/0049AKOS BBS-00003727RARECHEM AL BO 03212-(4-methoxyphenoxy)acetate(4-methoxyphenoxy)-aceticaci4-Methoxyphenyloxyacetic acid2-(4-methoxyphenoxy)aceticaci4-Methoxyphenoxyacetic acid,97%
DTXCID3035921BHFSBJHPPFJCOS-UHFFFAOYSA-N(4-Methoxyphenoxy)acetic acidP-methoxyphenoxyacetic acidAcetic acid, (p-methoxyphenoxy)-MFCD00014360Cambridge id 5163559TimTec1_002918

데이터베이스 식별자

CAS
1877-75-4
PubChem CID
74649
DTXSID
DTXSID2062030
ChEMBL
CHEMBL3247397
EC Number
217-513-2
Nikkaji
J199.690H

물성

구조 계산 물성

XLogP
1.2
극성 표면적
55.8 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
4
회전 가능 결합 수
4
무거운 원자 수
13

물리화학적 성질

녹는점
112 · 112-114 °C
끓는 점
275.56 °C · 275.56°C (rough estimate)
밀도
1.2481 · 1.2481 (rough estimate)
굴절률
1.4345 · 1.4345 (estimate)
저장 조건
Sealed in dry,Room Temperature
산도 계수 (pKa)
1 · pK1:3.213 (25°C)

화학적 성질

BEIGE-BROWN CRYSTALLINE SOLID

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (87%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (15.2%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (15.2%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (13%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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 5 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

Hazard Classes and CategoriesAcute Tox. 4 (87%);Skin Irrit. 2 (15.2%);Eye Irrit. 2 (15.2%);STOT SE 3 (13%)

안전 데이터

tsca
TSCA listed
HS 번호
29189990
risk_code
44-36/37/38
hazard_code
Xi
safety_code
37/39-26
위험 등급
IRRITANT

화학 및 산업

용도 및 제조

General Manufacturing InformationAcetic acid, 2-(4-methoxyphenoxy)-: INACTIVE

공급사50 곳

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]

관련 반응

43건

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