12-브로모도데칸산

12-Bromododecanoic Acid

HCID 175468

기본 정보

CAS
73367-80-3
표준 SMILES
O=C(O)CCCCCCCCCCCBr
InChIKey
YYKBWYBUCFHYPR-UHFFFAOYSA-N
분자식
C12H23BrO2
평균 분자량
279.21 g/mol
단동위원소 질량
278.08814

이름 및 식별자

우선 이름
12-Bromododecanoic Acid
IUPAC
12-bromododecanoic acid
현지명
12-브로모도데칸산
영어명
12-Bromododecanoic acid
분자식
C12H23BrO2
분자량
279.21

이름 및 동의어

12-Bromododecanoic acid73367-80-312-Bromolauric acidDodecanoic acid, 12-bromo-DTXSID1049354CHEBI:49519RP072ZQ00EDTXCID8029313RefChem:437326277-401-4MFCD0000273812-Brom-dodecansaeure
이름 더 보기
12-브로모도데칸산12-BroMododecanoic acid 97%12-Bromododecanoic acid - [B71783]
12-bromo-dodecanoic acid12-bromo-1-dodecanoic acidEINECS 277-401-4SCHEMBL93186C12-Br 12:0NSC660375DB0240512-Br 12:0

데이터베이스 식별자

CAS
73367-80-3
PubChem CID
175468
DTXSID
DTXSID1049354
ChEMBL
CHEMBL1231458
ChEBI
CHEBI:49519
UNII
RP072ZQ00E
EC Number
277-401-4
Nikkaji
J309.285B

물성

구조 계산 물성

XLogP
5
극성 표면적
37.3 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
2
회전 가능 결합 수
11
무거운 원자 수
15

물리화학적 성질

녹는점
52 · 52-55 °C (lit.)
끓는 점
140 · 140-143 °C(Press: 20 Torr)
밀도
1.191 · 1.191±0.06 g/cm3(Predicted)
인화점
230 °F · >230 °F
저장 조건
Sealed in dry,Room Temperature
용해도
50 mg/mL, · 클로로포름: 가용성 50mg/mL, 투명하거나 약간 흐릿함, 무색 내지 희미한 노란색

안전 및 규제

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for 33.3% (1 of 3) of reports.

Warning

H315 (66.7%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (66.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (66.7%): 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 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 1 of 3 reports by companies.;There are 2 notifications provided by 2 of 3 reports by companies with hazard statement code(s).;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 (66.7%);Eye Irrit. 2A (66.7%);STOT SE 3 (66.7%)

안전 데이터

wgk
3
HS 번호
2915907098
safety_code
22-24/25
스토리지 클래스
11 - Combustible Solids

화학 및 산업

응용 분야

용도12-Bromododecanoic acid ligand was used as a model fatty acid in the elucidation of the x-ray structure of bovine beta-lactoglobulin.

공급사69 곳

郑州阿尔法化工有限公司+86-18530059196 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
Sichuan Biosynce Pharmatech Co., Ltd.[email protected]

관련 반응

20건

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