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2-tert-butylpyrimidine-4-carboxylic acid
[CAS# 847955-90-2]

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Identification
Name 2-tert-butylpyrimidine-4-carboxylic acid
Synonyms 2-(tert-butyl)pyrimidine-4-carboxylic acid
Molecular Structure CAS#: 847955-90-2, 2-tert-butylpyrimidine-4-carboxylic acid
Molecular Formula C9H12N2O2
Molecular Weight 180.20
CAS Registry Number 847955-90-2
SMILES CC(C)(C)c1nc(ccn1)C(O)=O
InChI 1S/C9H12N2O2/c1-9(2,3)8-10-5-4-6(11-8)7(12)13/h4-5H,1-3H3,(H,12,13)
InChIKey SIIIVQRRLQDQJA-UHFFFAOYSA-N
Properties
Density 1.162g/cm3 (Cal.)
Boiling point 304.234°C at 760 mmHg (Cal.)
Flash point 137.796°C (Cal.)
Refractive index 1.527 (Cal.)
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