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4-(2-Pyrimidinylmethyl)Benzoic Acid
[CAS# 562803-70-7]

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Identification
Name 4-(2-Pyrimidinylmethyl)Benzoic Acid
Synonyms 4-Pyrimidin-2-ylmethyl-benzoic acid
Molecular Structure CAS#: 562803-70-7, 4-(2-Pyrimidinylmethyl)Benzoic Acid
Molecular Formula C12H10N2O2
Molecular Weight 214.22
CAS Registry Number 562803-70-7
SMILES C1=CN=C(N=C1)CC2=CC=C(C=C2)C(=O)O
InChI 1S/C12H10N2O2/c15-12(16)10-4-2-9(3-5-10)8-11-13-6-1-7-14-11/h1-7H,8H2,(H,15,16)
InChIKey MRWQACAGQLPROF-UHFFFAOYSA-N
Properties
Density 1.3±0.1g/cm3 (Cal.)
Boiling point 409.7±38.0°C at 760 mmHg (Cal.)
Flash point 201.6±26.8°C (Cal.)
Refractive index 1.617 (Cal.)
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