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N-1-(Pyrid-2-yl)butane-1,4-diamine

CAS
92992-91-1
Catalog Number
ACM92992911
Category
Other Products
Molecular Weight
165.235500 [g/mol]
Molecular Formula
C9H15N3

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Specification

Synonyms
N-(4-aminobutyl)pyridin-2-amine, 92992-91-1, AC1Q54GQ, 2-(4-aminobutylamino)pyridine, SCHEMBL1831059, 2-(4-amino-butylamino) pyridine, MolPort-008-424-341, RAJSAPSERUGCBT-UHFFFAOYSA-N, AKOS010115967, MCULE-3291375496, NE15344, 2-(n-(4-aminobut-1-yl)amino)pyridine, EN300-65411
IUPAC Name
N-pyridin-2-ylbutane-1,4-diamine
Canonical SMILES
C1=CC=NC(=C1)NCCCCN
InChI Key
RAJSAPSERUGCBT-UHFFFAOYSA-N
Boiling Point
323.4±22.0 °C (760 mmHg)
Density
1.063±0.06 g/cm³ (20 °C, 760 mmHg)
Exact Mass
165.12700
H-Bond Acceptor
3
H-Bond Donor
2
What is the molecular formula of N-1-(Pyrid-2-yl)butane-1,4-diamine?

The molecular formula is C9H15N3.

What is the molecular weight of N-1-(Pyrid-2-yl)butane-1,4-diamine?

The molecular weight is 165.24 g/mol.

What is the IUPAC name of N-1-(Pyrid-2-yl)butane-1,4-diamine?

The IUPAC name is N'-pyridin-2-ylbutane-1,4-diamine.

What is the InChIKey for N-1-(Pyrid-2-yl)butane-1,4-diamine?

The InChIKey is RAJSAPSERUGCBT-UHFFFAOYSA-N.

How many hydrogen bond donor counts does N-1-(Pyrid-2-yl)butane-1,4-diamine have?

It has 2 hydrogen bond donor counts.

What is the exact mass of N-1-(Pyrid-2-yl)butane-1,4-diamine?

The exact mass is 165.126597491 g/mol.

Does N-1-(Pyrid-2-yl)butane-1,4-diamine have any defined atom stereocenter counts?

No, it has 0 defined atom stereocenter counts.

How many rotatable bond counts does N-1-(Pyrid-2-yl)butane-1,4-diamine have?

It has 5 rotatable bond counts.

What is the topological polar surface area of N-1-(Pyrid-2-yl)butane-1,4-diamine?

The topological polar surface area is 50.9 Ų.

Is N-1-(Pyrid-2-yl)butane-1,4-diamine the canonicalized form?

Yes, the compound is canonicalized according to PubChem.

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