2,6-디메틸-3,5-헵탄디온

3,5-Heptanedione, 2,6-dimethyl-

HCID 87597CAS 18362-64-6
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
CC(C)C(=O)CC(=O)C(C)C
InChIKey
CEGGECULKVTYMM-UHFFFAOYSA-N
분자식
C9H16O2
평균 분자량
156.22 g/mol
단동위원소 질량
156.11502975

이름 및 식별자

우선 이름
3,5-Heptanedione, 2,6-dimethyl-
IUPAC
2,6-dimethylheptane-3,5-dione
현지명
2,6-디메틸-3,5-헵탄디온
영어명
2,6-Dimethyl-3,5-heptanedione
분자식
C9H16O2
분자량
156.22

이름 및 동의어

2,6-Dimethyl-3,5-heptanedione18362-64-63,5-Heptanedione, 2,6-dimethyl-EINECS 242-234-8DTXSID80879615RefChem:91638DTXCID201017624CEGGECULKVTYMM-UHFFFAOYSA-N2,6-Dimethylheptane-3,5-dioneMFCD00015040DiisobutyrylmethaneSCHEMBL181668
이름 더 보기
2,6-디메틸-3,5-헵탄디온2,6-dimethyl-5-heptanedioneAKOS MSC-03842,6-Dimethylheptan-3,5-dion2,6-Dimethyl-3,5-heptadione2,6-Dimethyl-3,5-heptanedione>2,6-Dimethyl-3,5-heptanedione,99%
2,6-dimethyl-3,5-heptandione2,6-dimethyl-heptane-3,5-dioneSBB056494AKOS004115273CS-W017999AS-47892SY010595A4059

데이터베이스 식별자

CAS
18362-64-6
PubChem CID
87597
DTXSID
DTXSID80879615
EC Number
242-234-8
Nikkaji
J266.134I

물성

구조 계산 물성

XLogP
1.9
극성 표면적
34.1 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
2
회전 가능 결합 수
4
무거운 원자 수
11

실험 및 물리화학적 성질

Kovats Retention Index1120；1076

물리화학적 성질

끓는 점
66 °C · 66 °C (8 mmHg)
밀도
1.4586 · 1.4586
굴절률
1.4575 · 1.4575-1.4595
인화점
62 °C · 62 °C
저장 조건
2 · 2-8°C
산도 계수 (pKa)
10.3 · 10.30±0.10(Predicted)

화학적 성질

clear colorless to light yellow liquid

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H226 (92.9%): Flammable liquid and vapor [Warning Flammable liquids]；H315 (92.9%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (92.9%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (92.9%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 14 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 CategoriesFlam. Liq. 3 (92.9%)；Skin Irrit. 2 (92.9%)；Eye Irrit. 2 (92.9%)；STOT SE 3 (92.9%)

안전 데이터

tsca
TSCA listed
ridadr
1224
HS 번호
29141990
risk_code
36/37/38
hazard_code
Xi
safety_code
37/39-26

화학 및 산업

용도 및 제조

General Manufacturing Information3,5-Heptanedione, 2,6-dimethyl-: ACTIVE

응용 분야

용도2,6-Dimethyl-3,5-heptanedione is a metal chelating agent and it is used in the preparation of metal diketonates for Metal-Organic Chemical Vapor Deposition (MOCVD).

상·하류 제품 정보

공급사50 곳

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]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

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