Basic information
- CAS
39190-66-4- Standard SMILES
CCCNCC(C)C- InChIKey
SQGSVBHTFQOZDL-UHFFFAOYSA-N- Molecular formula
- C7H17N
- Average molar mass
- 115.22 g/mol
- Monoisotopic mass
- 115.13609954
Overview
(2-Methylpropyl)(propyl)amine is a secondary amino compound.
Names & identifiers
- Preferred name
- (2-Methylpropyl)(propyl)amine
- IUPAC
- 2-methyl-N-propylpropan-1-amine
- English name
- PROPYLISOBUTYLAMINE
- Molecular formula
- C7H17N
- Molecular weight
- 115.22
Names & synonyms
2-Methyl-n-propyl-1-propanamine(2-methylpropyl)(propyl)amineRefChem:396139973-527-539190-66-42-methyl-N-propylpropan-1-aminePROPYLISOBUTYLAMINEPropylisobutyl amineIsobutyl-propyl-amineMFCD09929245isobutylpropylamineN-isobutyl-N-propylamine
Show more names
Isobutyl-n-propylamine1-Propanamine, 2-methyl-N-propyl-
propyl-isobutylaminen-propylisobutylaminepropyl isobutyl aminen-Propyl-isobutylaminSCHEMBL170842SCHEMBL269975SCHEMBL639648SCHEMBL639649
Database identifiers
- CAS
39190-66-4- PubChem CID
- 520943
- DTXSID
DTXSID50879021- ChEBI
CHEBI:184419- EC Number
- 973-527-5
- Nikkaji
- J1.560.361E
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 41.7
Experimental & physicochemical properties
LogP
2.07
2.07
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P319, P321, P330, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Pharmacology
Cellular LocationsCytoplasm
Suppliers7 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Wuhan Konberd Biotech Co., Ltd+undefined-18986093962 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
Accela ChemBio Inc.+1-858-6993322 +86-18019713315 · [email protected]
Additional notes
DefinitionChEBI: (2-Methylpropyl)(propyl)amine is a secondary amino compound.
Related reactions
2 records
Compound notes
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