기본 정보
- 표준 SMILES
CCCCCCNCCCCCC- InChIKey
PXSXRABJBXYMFT-UHFFFAOYSA-N- 분자식
- C12H27N
- 평균 분자량
- 185.35 g/mol
- 단동위원소 질량
- 185.21434986
개요
Dihexylamine is a clear colorless liquid. (NTP, 1992)
이름 및 식별자
- 우선 이름
- Dihexylamine
- IUPAC
- N-hexylhexan-1-amine
- 현지명
- 디노르말헥실아민
- 영어명
- Di-n-hexylamine
- 분자식
- C12H27N
- 분자량
- 185.35
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
143-16-8- PubChem CID
- 8920
- DTXSID
DTXSID1022009- ChEMBL
CHEMBL3188279- UNII
- K37ADA14ZV
- EC Number
- 205-588-4
- Nikkaji
- J27.960I
물성
구조 계산 물성
- XLogP
- 4.5
- 극성 표면적
- 12 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 10
- 무거운 원자 수
- 13
- 형식 전하
- 0
- 복잡도
- 71.2
실험 및 물리화학적 성질
Chemical Classes
Nitrogen Compounds -> Amines, Aliphatic
Flammable agents - 3rd degree
Physical Description
Dihexylamine is a clear colorless liquid. (NTP, 1992)
Colorless liquid; [CAMEO] Clear light yellow liquid; [Sigma-Aldrich MSDS]
물리화학적 성질
- 녹는점
- 3 °C · 3 °C
- 끓는 점
- 192 · 192-195 °C(lit.)
- 밀도
- 0.795 g/mL · 0.795 g/mL at 25 °C(lit.)
- 증기 밀도
- 6.4 · 6.4 (vs air)
- 증기압
- 0.05 hPa · 0.05 hPa (20 °C)
- 굴절률
- 20 · n20/D 1.432(lit.)
- 인화점
- 203 °F · 203 °F
- 저장 조건
- 30 °C · Store below +30°C.
- 용해도
- 0.3 g/L · 0.3g/L
- 산도 계수 (pKa)
- 1 · pK1:11.0(+1) (25°C)
- 물리적 상태
- 액체
- 색상
- 무색의
- 수소이온지수(pH)
- 9.9 · 9.9 (0.3g/l, H2O, 25℃)
- 폭발한계
- 0.7 · 0.7-5.9%(V)
- 수용성
- 물과 섞일 수 있습니다.
- Merck
- 14 · 14,7650
- BRN
- 1738519 · 1738519
- Henry's Law Constant
- 1.3 · 1.3×10-1 mol/(m3Pa) at 25℃, Yaws (2003)
- 안정성
- 안정적인. 타기 쉬운. 강한 산화제와 호환되지 않습니다.
- InChI
- 1S/C12H27N/c1-3-5-7-9-11-13-12-10-8-6-4-2/h13H,3-12H2,1-2H3
- InChIKey
- PXSXRABJBXYMFT-UHFFFAOYSA-N
- SMILES
- CCCCCCNCCCCCC
- EPA
- Dihexylamine (143-16-8)
화학적 성질
colourless liquid
안전 및 규제
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 0.7% (1 of 151) of reports.
Danger
H300 (72.2%): Fatal if swallowed [Danger Acute toxicity, oral]
P260, P262, P264, P264+P265, P270, P271, P273, P280, P284, P301+P316, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P320, P321, P330, P361+P364, P363, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 151 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Chemical: 1-Hexanamine, N-hexyl-
Dihexylamine: HSNO Approval: HSR004442 Approved with controls
The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)
Hazards Summary
A severe eye and mild skin irritant; [RTECS] Readily absorbed through skin; [NTP] Causes burns; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; Toxic by ingestion; Highly toxic by skin absorption; [Sigma-Aldrich MSDS] See 2-Ethylhexylamine.
Reactivity Profile
DIHEXYLAMINE 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. 2 (72.2%)
Flammable agents - 3rd degree
안전 및 보호
First Aid
EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.
Nonfire Spill Response
SMALL SPILLS AND LEAKAGE: If you spill this chemical, use absorbent paper to pick up all liquid spill material. Your contaminated clothing and absorbent paper should be sealed in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with alcohol followed by washing with a strong soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.
독성 정보
안전 데이터
- wgk
- 2
- tsca
- TSCA listed
- rtecs
- IH6600000
- ridadr
- UN 2922 8/PG 2
- 독성
- LD50 orally in Rabbit: 42 mg/kg LD50 dermal Rabbit < 160 mg/kg
- HS 번호
- 29211990
- risk_code
- 22-24-34
- hazard_code
- T
- safety_code
- 26-36/37/39-45
- 포장분류
- I
- 위험 등급
- 6.1
- 기존화학 물질
- KE-10587
- 자연 발화 온도
- 250 °C
- Hazard Classifications
- Acute Tox. 1 DermalAcute Tox. 2 InhalationAcute Tox. 2 OralAquatic Acute 1Aquatic Chronic 1Eye Dam. 1Skin Corr. 1A
- 스토리지 클래스
- 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials
화학 및 산업
용도 및 제조
응용 분야
용도Di-n-hexylamine is used in organic synthesis and involved in the preparation of succinic acid.
일반 설명Clear colorless liquid.
상·하류 제품 정보
상류 원료
하류 제품
공급사50 곳
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