3,4-디메틸티에노[2,3-B]티오펜-2-카발데하이드

3,4-Dimethylthieno[2,3-B]Thiophene-2-Carbaldehyde

HCID 2778771

기본 정보

CAS
159709-36-1
표준 SMILES
Cc1csc2sc(C=O)c(C)c12
InChIKey
WEAXSPMHCXWYPF-UHFFFAOYSA-N
분자식
C9H8OS2
평균 분자량
196.3 g/mol
단동위원소 질량
196.00165688

이름 및 식별자

우선 이름
3,4-Dimethylthieno[2,3-B]Thiophene-2-Carbaldehyde
IUPAC
3,4-dimethylthieno[2,3-b]thiophene-5-carbaldehyde
현지명
3,4-디메틸티에노[2,3-B]티오펜-2-카발데하이드
영어명
3,4-DIMETHYLTHIENO[2,3-B]THIOPHENE-2-CARBALDEHYDE
분자식
C9H8OS2
분자량
196.29

이름 및 동의어

3,4-Dimethylthieno[2,3-B]Thiophene-2-Carbaldehyde159709-36-1DTXSID803811223,4-dimethylthieno[2,3-b)thiophene-2-carbaldehydeRefChem:486385DTXCID103321473,4-dimethylthieno[2,3-b]thiophene-5-carbaldehyde3,4-Dimethylthieno[2,3-b]thiophene-2-carboxaldehydeMFCD00052282Thieno[2,3-b]thiophene-2-carboxaldehyde, 3,4-dimethyl-SCHEMBL1253035WEAXSPMHCXWYPF-UHFFFAOYSA-N
이름 더 보기
3,4-디메틸티에노[2,3-B]티오펜-2-카발데하이드BUTTPARK 92\04-793,4-Dimethyl-2-formylthieno[2,3-b]thiophene3,4-DIMETHYLTHIENO(B)THIOPHENE-2-CARBOXALDEHYDE
SBB092029AKOS006228222BP-10032BS-21607DB-004526CS-02074703,4-dimethylthiopheno[2,3-b]thiophene-2-carbaldehyde3,4-dimethylthieno[2,3-b]thiophene-2-carbaldehyde, AldrichCPR

데이터베이스 식별자

CAS
159709-36-1
PubChem CID
2778771
DTXSID
DTXSID80381122
EC Number
106-751-1
Nikkaji
J2.337.353J

물성

구조 계산 물성

XLogP
3.5
극성 표면적
73.6 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
3
회전 가능 결합 수
1
무거운 원자 수
12

물리화학적 성질

녹는점
147 · 147-149
물리적 상태
결정질 고체
색상
노란색
InChI
1S/C9H8OS2/c1-5-4-11-9-8(5)6(2)7(3-10)12-9/h3-4H,1-2H3
InChIKey
WEAXSPMHCXWYPF-UHFFFAOYSA-N
SMILES
Cc1csc2sc(C=O)c(C)c12

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (100%)

안전 데이터

wgk
WGK 3
HS 번호
2934999090
risk_code
22-36
hazard_code
Xi,Xn
safety_code
26
Hazard Classifications
Acute Tox. 4 OralEye Irrit. 2

화학 및 산업

공급사8 곳

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