(+/-)-2-아미노펜탄

2-Pentanamine

HCID 12246CAS 41444-43-3

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CCCC(C)N
InChIKey: IGEIPFLJVCPEKU-UHFFFAOYSA-N
분자식: C5H13N
평균 분자량: 87.16 g/mol
단동위원소 질량: 87.10479942

이름 및 식별자

우선 이름: 2-Pentanamine
IUPAC: pentan-2-amine
현지명: (+/-)-2-아미노펜탄
영어명: 2-AMINOPENTANE
분자식: C5H13N
분자량: 87.16

이름 및 동의어

63493-28-72-Pentylamine2-Pentanamine1-METHYLBUTYLAMINEsec-Amylamine1-Methyl-n-butylamineButylamine, 1-methyl-DL-2-AminopentaneMethylpropylcarbinylamineNSC 6367QH0285API3NSC-6367

이름 더 보기

(+/-)-2-아미노펜탄(+/-)-2-아미노펜탄((+/-)-2-AMINOPENTANE)2-Methylbutylamine2-AMYLAMINE2-AMINOPENTANEsec-pentylamine2-Aminopentane>2-AMINOPENTANE HCL(+/-)-2-pentanamin

(1)-1-MethylbutylamineEINECS 210-886-2EINECS 264-269-8DTXSID50870715RefChem:477803Butylamine, 1-methyl-(8CI)DTXCID10818411210-886-2

데이터베이스 식별자

CAS: 41444-43-3、625-30-9、63493-28-7
PubChem CID: 12246
DTXSID: DTXSID50870715
UNII: QH0285API3
EC Number: 210-886-2、255-366-6、264-269-8
Nikkaji: J129.194G

물성

구조 계산 물성

XLogP: 1
극성 표면적: 26 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 1
회전 가능 결합 수: 2
무거운 원자 수: 6
형식 전하: 0
복잡도: 27

물리화학적 성질

녹는점: 32 · 32-34 °C
끓는 점: 90.5 · 90.5-91.5 °C (lit.)
밀도: 0.736 g/mL · 0.736 g/mL at 25 °C (lit.)
굴절률: 20 · n20/D 1.4020(lit.)
인화점: 95 °F · 95 °F
저장 조건: 2 · 2-8°C
산도 계수 (pKa): 11.04 · 11.04±0.35(Predicted)
물리적 상태: 투명한 액체
색상: Colorless to Light yellow to Light orange
JECFA Number: 1586 · 1586
BRN: 635657 · 635657
InChI: 1S/C5H13N/c1-3-4-5(2)6/h5H,3-4,6H2,1-2H3
InChIKey: IGEIPFLJVCPEKU-UHFFFAOYSA-N
SMILES: CCCC(C)N
LogP: 1.41 · 1.410 (est)
EPA: 2 · 2-Pentanamine (63493-28-7)

화학적 성질

Clear light yellow liquid

안전 및 규제

GHS 분류

GHS Classification · 6건

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 39 reports by companies from 2 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.