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4-tert-Butylphenyl trans-4-(guanidinomethyl)cyclohexanecarboxylate
[CAS# 81907-78-0]

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CAS#: 81907-78-0
Product: 4-tert-Butylphenyl trans-4-(guanidinomethyl)cyclohexanecarboxylate
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Identification
Name 4-tert-Butylphenyl trans-4-(guanidinomethyl)cyclohexanecarboxylate
Synonyms (4-Tert-Butylphenyl) 4-(Guanidinomethyl)Cyclohexane-1-Carboxylate; 4-(Guanidinomethyl)-1-Cyclohexanecarboxylic Acid (4-Tert-Butylphenyl) Ester; 4-(Guanidinomethyl)Cyclohexane-1-Carboxylic Acid (4-Tert-Butylphenyl) Ester
Molecular Structure CAS#: 81907-78-0, 4-tert-Butylphenyl trans-4-(guanidinomethyl)cyclohexanecarboxylate
Molecular Formula C19H29N3O2
Molecular Weight 331.46
CAS Registry Number 81907-78-0
SMILES C1=C(C(C)(C)C)C=CC(=C1)OC(=O)C2CCC(CC2)CN=C(N)N
InChI 1S/C19H29N3O2/c1-19(2,3)15-8-10-16(11-9-15)24-17(23)14-6-4-13(5-7-14)12-22-18(20)21/h8-11,13-14H,4-7,12H2,1-3H3,(H4,20,21,22)
InChIKey HXLJIJAWKVNQNT-UHFFFAOYSA-N
Properties
Density 1.158g/cm3 (Cal.)
Boiling point 487.554°C at 760 mmHg (Cal.)
Flash point 248.664°C (Cal.)
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