1,3-Diaminopropane

CAT: 0572-TRC-D416660-10GSize: 10 gDry Ice: NoHazardous: Yes

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CAT#:0572-TRC-D416660-10GSize:10 g

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CAS Number

109-76-2

Synonyms

1,3-Diamino-n-propane; 1,3-Diaminopropane; 1,3-Propylenediamine; 1,3-Trimethylenediamine; 3-Aminopropylamine; DAP; NSC 8154; TMEDA; Trimethylenediamine; alpha,ω-Propanediamine

Hazard Statement

Flammable liquid and vapour; UN number: UN2922; Packing Group: II

Purity

>95% (GC)

Smiles

NCCCN

Molecular Formula

C3H10N2

Molecular Weight

74.12

Shipping Conditions

Room Temperature

Storage Conditions

+20°C

Chemical Information

1,3-Propanediamine

Trimethylenediamine is an alkane-alpha,-diamine comprising a propane skeleton with amino substituents at positions 1 and 3. It has a role as a reagent, a mouse metabolite and a human metabolite. It is a conjugate base of a trimethylenediaminium.

CAS Number	109-76-2
PubChem CID	428
IUPAC Name	propane-1,3-diamine
Molecular Formula	C3H10N2
Molecular Weight	74.13
XLogP	-1.4
Topological Polar Surface Area	52
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	5
Formal Charge	0
Complexity	12

SMILES

C(CN)CN

InChI

InChI=1S/C3H10N2/c4-2-1-3-5/h1-5H2

InChIKey

XFNJVJPLKCPIBV-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 109-76-2

CID: 428

Formula: C3H10N2

MW: 74.13

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	74.13
XLogP3	-1.4
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	74.084398327
Monoisotopic Mass	74.084398327
Topological Polar Surface Area	52 Å²
Heavy Atom Count	5
Formal Charge	0
Complexity	12.4
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

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Catalog	Name
MBS3845236-01	1, 3-Diaminopropane
sc-255920	1,3-Diaminopropane
FT178891	Triethylborane-1,3-diaminopropane
sc-222948	1,3-Diaminopropane dihydrochloride
OR1009187-01	1,3-Diaminopropane Dihydrobromide
OR80576-01	1,3-Diaminopropane Dihydroiodide
sc-214879	Didansyl-1,3-diaminopropane
D05860	1,3-Diaminopropane 99%
A20795-100	1,3-Diaminopropane 100mg
411010-01	1,3-Diaminopropane-d6

1,3-Diaminopropane

Chemical Information

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