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5-Butyl-2-pyrimidinecarboxylic acid
[CAS# 72790-09-1]

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Identification
Name 5-Butyl-2-pyrimidinecarboxylic acid
Synonyms 5-butylpyrimidine-2-carboxylic acid
Molecular Structure CAS#: 72790-09-1, 5-Butyl-2-pyrimidinecarboxylic acid
Molecular Formula C9H12N2O2
Molecular Weight 180.20
CAS Registry Number 72790-09-1
SMILES O=C(O)c1ncc(CCCC)cn1
InChI 1S/C9H12N2O2/c1-2-3-4-7-5-10-8(9(12)13)11-6-7/h5-6H,2-4H2,1H3,(H,12,13)
InChIKey CIAGNHFWEATGBA-UHFFFAOYSA-N
Properties
Density 1.168g/cm3 (Cal.)
Boiling point 370.66°C at 760 mmHg (Cal.)
Flash point 177.969°C (Cal.)
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