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Di-n-amylamine

CAT: 0127-OR10118Size: 1 EachDry Ice: NoHazardous: No
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CAS Number
2050-92-2
MDL Number
MFCD00009499
Smiles
CCCCCNCCCCC

Chemical Information

Dipentylamine

Di-n-amylamine appears as a clear colorless liquid with an ammonia-like odor. Very slightly soluble in water. Less dense less than water. Vapors heavier than air. Difficult to ignite. Moderately toxic. Contact with liquid may cause a chemical burn. Vapors may irritate respiratory tract. Used in the manufacture of rubber, resins, and dyes.

CAS Number2050-92-2
PubChem CID16316
IUPAC NameN-pentylpentan-1-amine
Molecular FormulaC10H23N
Molecular Weight157.30
XLogP3.4
Topological Polar Surface Area12
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count8
Heavy Atom Count11
Formal Charge0
Complexity53
SMILES
CCCCCNCCCCC
InChI
InChI=1S/C10H23N/c1-3-5-7-9-11-10-8-6-4-2/h11H,3-10H2,1-2H3
InChIKey
JACMPVXHEARCBO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dipentylamine
CAS: 2050-92-2
CID: 16316
Formula: C10H23N
MW: 157.30
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight157.30
XLogP33.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count8
Exact Mass157.183049738
Monoisotopic Mass157.183049738
Topological Polar Surface Area12 Ų
Heavy Atom Count11
Formal Charge0
Complexity53.9
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes