기본 정보
- 표준 SMILES
CCCCCCCCCCN(C)CCCCCCCCCC- InChIKey
ATBNMWWDBWBAHM-UHFFFAOYSA-N- 분자식
- C21H45N
- 평균 분자량
- 311.6 g/mol
- 단동위원소 질량
- 311.35520044
개요
Didecylmethyl amine appears as a clear slightly light yellow liquid with a fishlike odor. Insoluble in water and less dense than water. Hence floats on water. Contact may irritate skin, eyes and mucous membranes. May be toxic by ingestion, inhalation or skin absorption. Used to make other chemicals.
이름 및 식별자
- 우선 이름
- 1-Decanamine, N-decyl-N-methyl-
- IUPAC
- N-decyl-N-methyldecan-1-amine
- 현지명
- N-메틸디데실아민
- 영어명
- N-Methyldidecylamine
- 분자식
- C21H45N
- 분자량
- 311.59
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
7396-58-9- PubChem CID
- 81880
- DTXSID
DTXSID5027649- EC Number
- 230-990-1
- Nikkaji
- J278.807A
물성
구조 계산 물성
- XLogP
- 9.3
- 극성 표면적
- 3.2 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 18
- 무거운 원자 수
- 22
- 형식 전하
- 0
- 복잡도
- 170
실험 및 물리화학적 성질
Physical Description
Didecylmethyl amine appears as a clear slightly light yellow liquid with a fishlike odor. Insoluble in water and less dense than water. Hence floats on water. Contact may irritate skin, eyes and mucous membranes. May be toxic by ingestion, inhalation or skin absorption. Used to make other chemicals.
Liquid; CBI
물리화학적 성질
- 녹는점
- -7.4 °C · -7.4 °C
- 끓는 점
- 145 °C · 145 °C / 2mmHg
- 밀도
- 0.807 g/mL · 0.807 g/mL at 20 °C(lit.)
- 굴절률
- 20 · n20/D 1.448
- 인화점
- 93 °C · 93°C
- 산도 계수 (pKa)
- 9.83 · 9.83±0.50(Predicted)
- 물리적 상태
- 투명한 액체
- 색상
- Colorless to Light yellow to Light orange
- 수용성
- 1.2 μg/L · 1.2μg/L
- BRN
- 1765810 · 1765810
- InChI
- InChI=1S/C21H45N/c1-4-6-8-10-12-14-16-18-20-22(3)21-19-17-15-13-11-9-7-5-2/h4-21H2,1-3H3
- InChIKey
- ATBNMWWDBWBAHM-UHFFFAOYSA-N
- SMILES
- C(N(CCCCCCCCCC)C)CCCCCCCCC
- LogP
- 8.8 · 8.8
- EPA
- Didecylmethylamine (7396-58-9)
안전 및 규제
GHS 분류
GHS Classification
Danger
H302 (96.2%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P264, P264+P265, P270, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P332+P317, P362+P364, P363, P391, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 211 reports by companies from 16 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Warning
H302: Harmful if swallowed [Warning Acute toxicity, oral]
유해성 정보
Regulatory Information
Chemical: 1-Decanamine, N-decyl-N-methyl-
1-Decanamine, N-decyl-N-methyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Decanamine, N-decyl-N-methyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
REACH registered substance: N-methyldidecylamine (EC: 230-990-1)
1-Decanamine, N-decyl-N-methyl-: Does not have an individual approval but may be used under an appropriate group standard
Reactivity Profile
DIDECYLMETHYL AMINE neutralizes acids in exothermic reactions to form salts plus water. May be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen may be generated in combination with strong reducing agents, such as hydrides.
Hazard Classes and Categories
Acute Tox. 4 (96.2%)
Acute toxicity (Oral) - Category 4
안전 및 보호
안전 데이터
- wgk
- 2
- tsca
- TSCA listed
- ridadr
- UN 2735 8/PG 3
- HS 번호
- 2921.19.6190
- 포장분류
- II
- 위험 등급
- 8
- 기존화학 물질
- 2010-3-4670
- F 고인화성물질
- 9-34
- Hazard Classifications
- Acute Tox. 4 OralAquatic Acute 1Aquatic Chronic 1Skin Irrit. 2
- 스토리지 클래스
- 10 - Combustible liquids
화학 및 산업
용도 및 제조
General Manufacturing Information
All Other Basic Organic Chemical Manufacturing
1-Decanamine, N-decyl-N-methyl-: ACTIVE
응용 분야
용도N-Methyldidecylamine is a reagent used in the synthesis of novel anthraquinone compounds which act as potential anticancer compounds.
일반 설명A clear slightly light yellow liquid with a fishlike odor. Insoluble in water and less dense than water. Hence floats on water. Contact may irritate skin, eyes and mucous membranes. May be toxic by ingestion, inhalation or skin absorption. Used to make other chemicals.
상·하류 제품 정보
상류 원료
하류 제품
공급사50 곳
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