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5-(4-methylpentyl)-1H-pyrimidine-2,4-dione

HCID 289977
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Basic information

CAS
41244-61-5
Standard SMILES
CC(C)CCCc1c[nH]c(=O)[nH]c1=O
InChIKey
BFNBFKWJHOHLQO-UHFFFAOYSA-N
Molecular formula
C10H16N2O2
Average molar mass
196.25 g/mol
Monoisotopic mass
196.12117776

Names & identifiers

Preferred name
5-(4-methylpentyl)-1H-pyrimidine-2,4-dione
IUPAC
5-(4-methylpentyl)-1H-pyrimidine-2,4-dione

Names & synonyms

41244-61-5NSC152521DTXSID80961529BFNBFKWJHOHLQO-UHFFFAOYSA-NNSC-1525215-(4-Methylpentyl)pyrimidine-2,4-diol

Database identifiers

CAS
41244-61-5
PubChem CID
289977
DTXSID
DTXSID80961529

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
58.2 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
14
Formal charge
0
Complexity
269

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Compound notes

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