CAS 4963-47-7 | N1,N1-Bis(3-aminopropyl);propane-1,3-diamine | CAS Number 4963-47-7

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4963-47-7 | N1,N1-Bis(3-aminopropyl);propane-1,3-diamine

CAS No: 4963-47-7 Catalog No: AG003SNN MDL No:MFCD00191593

Product Description

Catalog Number:

AG003SNN

Chemical Name:

N1,N1-Bis(3-aminopropyl);propane-1,3-diamine

CAS Number:

4963-47-7

Molecular Formula:

C9H24N4

Molecular Weight:

188.3137

MDL Number:

MFCD00191593

IUPAC Name:

N',N'-bis(3-aminopropyl)propane-1,3-diamine

InChI:

InChI=1S/C9H24N4/c10-4-1-7-13(8-2-5-11)9-3-6-12/h1-12H2

InChI Key:

QMXSDTGNCZVWTB-UHFFFAOYSA-N

SMILES:

NCCCN(CCCN)CCCN

Properties

Complexity:

78.6

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

188.2g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

188.319g/mol

Monoisotopic Mass:

188.2g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

81.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-1.5

Literature

Title	Journal
Synthesis and characterization of manganese(II) and iron(III) d5 tripodal imidazole complexes. Effect of oxidation state, protonation state and ligand conformation on coordination number and spin state.	Dalton transactions (Cambridge, England : 2003) 20060227
Synthesis and characterization of seven-coordinate tripodal imidazole complexes of iron(II) and manganese(II).	Dalton transactions (Cambridge, England : 2003) 20051121
Dynamic structural change of a twisted hexaporphyrin complex by highly specific molecular recognition.	Inorganic chemistry 20040531
A study on oxygen insertion in dinuclear silver cryptates.	Dalton transactions (Cambridge, England : 2003) 20040407