Di-n-butylethylamine

CAT: 0127-OR451313-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0127-OR451313-01Size:1 g

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CAS Number

4458-33-7

MDL Number

MFCD00051919

Purity

=95%

Smiles

CCCCN(CC)CCCC

Storage Conditions

Store at 2-8°C

Chemical Information

Di-n-butylethylamine

CAS Number	4458-33-7
PubChem CID	78207
IUPAC Name	N-butyl-N-ethylbutan-1-amine
Molecular Formula	C10H23N
Molecular Weight	157.30
XLogP	3.1
Topological Polar Surface Area	3.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	7
Heavy Atom Count	11
Formal Charge	0
Complexity	63

SMILES

CCCCN(CC)CCCC

InChI

InChI=1S/C10H23N/c1-4-7-9-11(6-3)10-8-5-2/h4-10H2,1-3H3

InChIKey

BBDGYADAMYMJNO-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 4458-33-7

CID: 78207

Formula: C10H23N

MW: 157.30

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	157.30
XLogP3	3.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	7
Exact Mass	157.183049738
Monoisotopic Mass	157.183049738
Topological Polar Surface Area	3.2 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	63.3
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
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OR1026792-01	N, N-Di-N-Butylethylenediamine
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OR1053541-01	Di-n-octylsulfone
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Catalog	Name
sc-234531	Di-n-butylethylamine
EAA43277-01	N-tert-Butylethylamine
478728	CTBS (Di-N-acetylchitobiase, Chitobiase, di-N-acetyl-)
sc-279808	N, N-Di-n-propylformamide
sc-269928	N, N'-Di-n-propylethylenediamine
D12350-01	N, N'-Di-n-butylthiourea
sc-279807	N, N-Di-n-butyllactamide
sc-331511	N, N'-Di-n-butylethylenediamine
sc-269904	N, N-Di-n-butylethylenediamine
sc-236107	N, N-Di-N-hexylaniline