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Structure

5-Tetradecylpyrimidine-2,4,6-triamine

CAS
94087-77-1
Catalog Number
ACM94087771
Category
Other Products
Molecular Weight
321.504000 [g/mol]
Molecular Formula
C18H35N5

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Specification

Synonyms
EINECS 301-971-6, 5-Tetradecylpyrimidine-2,4,6-triamine, CID3023449, 94087-77-1
IUPAC Name
5-tetradecylpyrimidine-2,4,6-triamine
Canonical SMILES
CCCCCCCCCCCCCCC1=C(N=C(N=C1N)N)N
InChI Key
ZYBZGAVYYLHNQK-UHFFFAOYSA-N
Boiling Point
537.5ºC at 760mmHg
Flash Point
312.5ºC
Density
1.025g/cm³
EC Number
301-971-6
Exact Mass
321.28900
H-Bond Acceptor
5
H-Bond Donor
3
What is the molecular formula of 5-Tetradecylpyrimidine-2,4,6-triamine?

The molecular formula is C18H35N5.

When was 5-Tetradecylpyrimidine-2,4,6-triamine created in PubChem?

It was created on August 8, 2005.

What is the IUPAC name of 5-Tetradecylpyrimidine-2,4,6-triamine?

The IUPAC name is 5-tetradecylpyrimidine-2,4,6-triamine.

What is the InChIKey of 5-Tetradecylpyrimidine-2,4,6-triamine?

The InChIKey is ZYBZGAVYYLHNQK-UHFFFAOYSA-N.

What is the Canonical SMILES of 5-Tetradecylpyrimidine-2,4,6-triamine?

The Canonical SMILES is CCCCCCCCCCCCCCC1=C(N=C(N=C1N)N).

What is the molecular weight of 5-Tetradecylpyrimidine-2,4,6-triamine?

The molecular weight is 321.5 g/mol.

How many hydrogen bond donor count does 5-Tetradecylpyrimidine-2,4,6-triamine have?

It has 3 hydrogen bond donor counts.

What is the topological polar surface area of 5-Tetradecylpyrimidine-2,4,6-triamine?

The topological polar surface area is 104 Ų.

How many rotatable bond counts does 5-Tetradecylpyrimidine-2,4,6-triamine have?

It has 13 rotatable bond counts.

Is the compound canonicalized in PubChem?

Yes, the compound is canonicalized in PubChem.

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