(6aS-(6aalpha,7alpha,8beta,9aalpha))-2-Amino-1,6,6a,7,8,9a-hexahydro-7-hydroxy-8-(hydroxymethyl)-Formaldehyde
[CAS# 100016-73-7]

Identification

• Name: (6aS-(6aalpha,7alpha,8beta,9aalpha))-2-Amino-1,6,6a,7,8,9a-hexahydro-7-hydroxy-8-(hydroxymethyl)-Formaldehyde
• Synonyms: 4-Chlorophenol; Formaldehyde; 1,7,7-Trimethylnorbornan-2-One; 4-Chlorophenol; Formaldehyde; 1,7,7-Trimethyl-2-Norbornanone
• Molecular Formula: C₁₇H₂₃ClO₃
• Molecular Weight: 310.82
• CAS Registry Number: 100016-73-7
• SMILES: C1=C(Cl)C=CC(=C1)O.CC23C(C(CC2=O)CC3)(C)C.O=C
• InChI: 1S/C10H16O.C6H5ClO.CH2O/c1-9(2)7-4-5-10(9,3)8(11)6-7;7-5-1-3-6(8)4-2-5;1-2/h7H,4-6H2,1-3H3;1-4,8H;1H2
• InChIKey: BPBFTWFEDDZSSY-UHFFFAOYSA-N

Properties

• Boiling point: 207.4°C at 760 mmHg (Cal.)
• Flash point: 64.4°C (Cal.)