2,4,6-트리메톡시벤즈알데히드

2,4,6-Trimethoxybenzaldehyde

HCID 70019CAS 830-79-5
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
COc1cc(OC)c(C=O)c(OC)c1
InChIKey
CRBZVDLXAIFERF-UHFFFAOYSA-N
분자식
C10H12O4
평균 분자량
196.2 g/mol
단동위원소 질량
196.07355886

이름 및 식별자

우선 이름
2,4,6-Trimethoxybenzaldehyde
IUPAC
2,4,6-trimethoxybenzaldehyde
현지명
2,4,6-트리메톡시벤즈알데히드
영어명
2,4,6-Trimethoxybenzaldehyde
분자식
C10H12O4
분자량
196.2

이름 및 동의어

2,4,6-TrimethoxybenzaldehydeBenzaldehyde, 2,4,6-trimethoxy-DTXSID70232119JD365X6J84CRBZVDLXAIFERF-UHFFFAOYSA-RefChem:82133DTXCID20154610212-598-24-08-00-02717 (Beilstein Handbook Reference)CRBZVDLXAIFERF-UHFFFAOYSA-NInChI=1/C10H12O4/c1-12-7-4-9(13-2)8(6-11)10(5-7)14-3/h4-6H,1-3H3830-79-5
이름 더 보기
2,4,6-트리메톡시벤즈알데히드2,4,6-트라이메쏘옥시벤즈알데하이드2,4,6-트리메톡시벤즈알데하이드AKOS BBS-00003255TIMTEC-BB SBB0003512,4,6-TrimethoxybenzaLTrimetazidine Impurity 112,4,6-Methoxybenzaldehyde2,4,6-Trimethoxybenzaldehyde98%2,4,6-Trimethoxybenzaldehyde 98%1-Formyl-2,4,6-trimethoxybenzene
MFCD00003313BCP335902,4,6-Trimethoxybenzaldehyde, 98%BBL027431ZB1376AC-12837SY015346A840500

데이터베이스 식별자

CAS
830-79-5
PubChem CID
70019
DTXSID
DTXSID70232119
ChEMBL
CHEMBL2234486
UNII
JD365X6J84
EC Number
212-598-2
Nikkaji
J109K

물성

구조 계산 물성

XLogP
1.3
극성 표면적
44.8 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
4
회전 가능 결합 수
4
무거운 원자 수
14

물리화학적 성질

녹는점
115 · 115-120 °C (lit.)
끓는 점
293.08 °C · 293.08°C (rough estimate)
밀도
1.2166 · 1.2166 (rough estimate)
굴절률
1.555 · 1.5550 (estimate)
저장 조건
Keep in dark place,Sealed in dry,Room Temperature
용해도
클로로포름(약간 용해됨), 메탄올(약간 용해됨)

화학적 성질

pink crystal power

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (83.3%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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 6 reports by companies from 3 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 CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (83.3%)

안전 데이터

wgk
3
rtecs
CU8460200
HS 번호
29124990
risk_code
36/37/38-34
hazard_code
C
safety_code
22-24/25-45-36/37/39-27-26

화학 및 산업

응용 분야 · 2건

용도2,4,6-Trimethoxybenzaldehyde was used in the preparation and characterization of three RNA-specific fluorescent probes and their use in live cell imaging. It was used as starting reagent for the regioselective synthesis of new (+/-)-8-alkyl-5,7-dihydroxy-4-(4-hydroxyphenyl)-3,4-dihydrocoumarins.

일반 설명2,4,6-Trimethoxybenzaldehyde exhibits significant anti-candida activity.

상·하류 제품 정보

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]

관련 반응

29건
반응 기록 만들기

연결된 노트

불러오는 중…