3-(Methylthio)propylamine

HCID 77743
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기본 정보

CAS
4104-45-4
표준 SMILES
CSCCCN
InChIKey
KKYSBGWCYXYOHA-UHFFFAOYSA-N
분자식
C4H11NS
평균 분자량
105.2 g/mol
단동위원소 질량
105.06122035

개요

3-methylthiopropylamine is a derivative of propylamine having a methylmercapto group at the 3-position. It is an organic sulfide and a primary amino compound. It is functionally related to a 3-aminopropane-1-thiol and a propylamine. It is a conjugate base of a 3-methylthiopropylaminium.

이름 및 식별자

우선 이름
3-(Methylthio)propylamine
IUPAC
3-methylsulfanylpropan-1-amine
영어명
3-(Methylthio)propylamine
분자식
C4H11NS
분자량
105.2

이름 및 동의어

3-(Methylthio)propylamine4104-45-43-Methylthiopropylamine1-Propanamine, 3-(methylthio)-3-(methylsulfanyl)propan-1-amine3-methylsulfanylpropan-1-amine3-(methylthio)-1-propanamine1IAP0CGD5S3-Aminopropyl methyl sulfide3-(Methylmercapto)propylamineDTXSID10633001-AMINO-3-(METHYLTHIO)PROPANE
이름 더 보기
4104-45-4 1,3-Dioxane3-(Methylmercapto)-propMethylmercaptopropylamine3-Methylthiopropylamine>3-(methylthio)-1-propanamin3-METHYLMERCAPTOPROPYLAMINE3-(Methylthio)propan-1-aMine3-METHYLTHIOPROPYLAMINE 96+%Methyl 3-aminopropyl sulfide
S-METHYLHOMOCYSTEAMINE3-(methylsulfanyl)propylamineFEMA NO. 4649CHEBI:16696RefChem:5043733-MTPADTXCID6039849223-875-2

데이터베이스 식별자

CAS
4104-45-4
PubChem CID
77743
DTXSID
DTXSID1063300
ChEBI
CHEBI:16696
UNII
1IAP0CGD5S
EC Number
223-875-2
Nikkaji
J146.566J

물성

구조 계산 물성

XLogP
0.3
극성 표면적
51.3 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
2
회전 가능 결합 수
3
무거운 원자 수
6

실험 및 물리화학적 성질

Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Density0.958-0.964 (20 °C)
Solubility · 2건

Practically insoluble or insoluble in water

Soluble (in ethanol)

Boiling Point96-98 °C (60 mm Hg)
Refractive Index1.489-1.495
Physical DescriptionClear slightly yellow liquid; Pungent penetrating aroma

물리화학적 성질

끓는 점
169 °C · 169 °C(lit.)
밀도
0.938 g/mL · 0.938 g/mL at 25 °C(lit.)
굴절률
20 · n20/D 1.4940(lit.)
FEMA
4649 · 4649 | 3-(METHYLTHIO)PROPYLAMINE
인화점
62 °C · 62 °C
물리적 상태
액체

화학적 성질

CLEAR COLOURLESS LIQUID

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 0.7% (1 of 138) of reports.

Danger

H314 (70.3%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P321, P332+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 138 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 2건

Chemical: 1-Propanamine, 3-(methylthio)-

1-Propanamine, 3-(methylthio)-: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesSkin Corr. 1C (70.3%)

안전 데이터

wgk
3
tsca
TSCA listed
ridadr
UN2735
HS 번호
29309090
risk_code
37/38-41
hazard_code
Xi,C

화학 및 산업

용도 및 제조

Use Classification · 2건

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

Flavoring Agents -> JECFA Flavorings Index

General Manufacturing Information1-Propanamine, 3-(methylthio)-: ACTIVE

응용 분야

용도3-(Methylthio)propylamine can be used in the synthesis of rhodium(III)complexes involving acyclic diaminedithioether(DADTE)ligands.

상·하류 제품 정보

공급사72 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
湖南韵邦生物科技股份有限公司85561037 15386497078 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]

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