1-Heptanamine

HCID 8127CAS 111-68-2
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
CCCCCCCN
InChIKey
WJYIASZWHGOTOU-UHFFFAOYSA-N
분자식
C7H17N
평균 분자량
115.22 g/mol
단동위원소 질량
115.13609955

이름 및 식별자

우선 이름
1-Heptanamine
IUPAC
heptan-1-amine
현지명
1-헵탄아민
영어명
1-Aminoheptane
분자식
C7H17N
분자량
115.22

이름 및 동의어

Heptylamine1-AminoheptaneN-HEPTYLAMINE1-HeptanamineDTXSID7020681NSC 2074EINECS 203-895-8BRN 1731688AI3-24038DTXCID506814-04-00-00734 (Beilstein Handbook Reference)RefChem:432909
이름 더 보기
1-헵탄아민1-아민헵탄AMINE C7Heptylaminn-HeptylaminCH3(CH2)6NH2AminoheptaneN-HEPYLAMINE1-Aminoheptan
203-895-8111-68-2heptan-1-amine1-Heptylamineheptyl-amineMFCD00008244NSC-2074Heptanamine

데이터베이스 식별자

CAS
111-68-2
PubChem CID
8127
DTXSID
DTXSID7020681
ChEMBL
CHEMBL3561940
ChEBI
CHEBI:182628
UNII
B4GL3L6JSL
EC Number
203-895-8
Nikkaji
J45.690J

물성

구조 계산 물성

XLogP
2.6
극성 표면적
26 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
1
회전 가능 결합 수
5
무거운 원자 수
8

실험 및 물리화학적 성질

Ionization Efficiency · 6건

Positive

3.51

2.7

Agilent XCT

Electrospray ionization

formic acid (5.3nM)

Kovats Retention Index · 3건

930；937；941；928；943.2；939；930；931；931；942；932；933；934；935

918；930；931；932；932；932；932；932；933；933；933；933；934；934；935；931；932；933；933；934

1218；1215；1215；1217；1219；1220；1223；1213

물리화학적 성질

녹는점
-23 °C · -23 °C
끓는 점
154 · 154-156 °C(lit.)
밀도
0.777 g/mL · 0.777 g/mL at 25 °C(lit.)
증기압
4.3 · 4.3-8hPa at 20-30℃
굴절률
20 · n20/D 1.424(lit.)
인화점
95 °F · 95 °F

화학적 성질

1-Aminoheptane is a flammable liquid.

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]；H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 47 reports by companies from 5 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

Regulatory Information · 3건

Chemical: 1-Heptanamine

Status: Cease Manufacture Update: 08-12-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/21376

1-Heptanamine: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesFlam. Liq. 3 (100%)；Skin Corr. 1A (100%)

규제 정보

Regulatory Information · 3건

Chemical: 1-Heptanamine

Status: Cease Manufacture Update: 08-12-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/21376

1-Heptanamine: Does not have an individual approval but may be used under an appropriate group standard

안전 데이터

wgk
1
tsca
TSCA listed
rtecs
MK0600000
ridadr
UN 2734 8/PG 2
독성
mouse,LD50,intraperitoneal,100mg/kg (100mg/kg),Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 30, Pg. 623, 1941.
HS 번호
29211999

화학 및 산업

용도 및 제조

General Manufacturing Information1-Heptanamine: ACTIVE

응용 분야

용도Heptylamine is used in organic syntheses.

상·하류 제품 정보

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
宁波君龙新材料有限公司0574 88552216 19032109277 · [email protected]

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