N-(1-Methylpropyl)-2-butanamine

C₈H₁₉NCAS 626-23-3129.25 g/mol

Open in Covalent MOL file

Secondary amine

Properties

Molecular formula: C₈H₁₉N
Molar mass: 129.25 g/mol
Exact mass: 129.1517 Da
Boiling point: 135 °C
logP: 2.17Crippen estimate
Polar surface area: 12.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 4

Hazards

Warning

H226 Flammable liquid and vapor100% of notifiers
H302+H312+H332 Harmful if swallowed, in contact with skin or if inhaled10% of notifiers
H302 Harmful if swallowed100% of notifiers
H312 Harmful in contact with skin100% of notifiers
H332 Harmful if inhaled100% of notifiers

Aggregated from 80 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P261, P264, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P317, P321, P330, P362+P364, P370+P378, P403+P235, P501

Identifiers

CAS number

626-23-3

SMILES

CCC(C)NC(C)CC

InChIKey

OBYVIBDTOCAXSN-UHFFFAOYSA-N

InChI

InChI=1S/C8H19N/c1-5-7(3)9-8(4)6-2/h7-9H,5-6H2,1-4H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

9 names

2-Butanamine, N-(1-methylpropyl)-
Di-sec-butylamine
Bis(1-methylpropyl)amine
Di-2-butylamine
Bis(sec-butyl)amine
NSC 8703
N,N-Di-sec-butylamine
N,N-Bis(1-methylpropyl)amine
Bis(2-butyl)amine

Work with N-(1-Methylpropyl)-2-butanamine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N,N′-Di-2-butyl-1,4-phenylenediamine101-96-248 % similar 2,6-Dimethylpiperazine108-49-647 % similar Rel-(2R,6S)-2,6-Dimethylpiperazine21655-48-147 % similar 2,6-Dimethylpiperidine504-03-047 % similar Rel-(2R,6S)-2,6-Dimethylpiperidine766-17-647 % similar 4,4′-Bis(sec-butylamino)diphenylmethane5285-60-939 % similar 3,4-Dimethylhexane583-48-239 % similar Isopentane78-78-439 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Ethylhexylamine104-75-6 2,4,4-Trimethyl-2-pentanamine107-45-9 Diisobutylamine110-96-3 Octylamine111-86-4 Dibutylamine111-92-2 N,N-Dimethylhexylamine4385-04-0 (±)-1,5-Dimethylhexylamine543-82-8 (±)-2-Octanamine693-16-3

Elsewhere

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