Description

1,3-Adamantanediol (CAS: 5001-18-3) is a high-purity diol derivative of adamantane, featuring a rigid, cage-like molecular structure with two hydroxyl groups at the 1 and 3 positions. This compound, with the molecular formula C₁₀H₁₆O₂, is widely utilized in pharmaceutical research, polymer chemistry, and materials science due to its unique steric and electronic properties. Its symmetrical tricyclic framework enhances thermal stability and resistance to degradation, making it ideal for advanced applications. Available at ≥99.0% purity (GC), our 1,3-Adamantanediol is rigorously tested for consistency, ensuring optimal performance in synthetic and formulation workflows. Suitable for lab-scale experiments or industrial-scale production, this compound is packaged under inert conditions to maintain integrity.

Properties

• CAS Number: 5001-18-3
• Complexity: 190
• IUPAC Name: adamantane-1,3-diol
• InChI: InChI=1S/C10H16O2/c11-9-2-7-1-8(4-9)5-10(12,3-7)6-9/h7-8,11-12H,1-6H2
• InChI Key: MOLCWHCSXCKHAP-UHFFFAOYSA-N
• Exact Mass: 168.115029749
• Molecular Formula: C10H16O2
• Molecular Weight: 168.23
• SMILES: C1C2CC3(CC1CC(C2)(C3)O)O
• Topological: 40.5
• Monoisotopic Mass: 168.115029749
• Synonyms: 1,3-Adamantanediol, 5001-18-3, 1,3-Adamantandiol, 1,3-Dihydroxyadamanatane, DTXSID30198181, DTXCID60120672, 677-075-7, 1,3-Dihydroxyadamantane, Adamantane-1,3-diol, Tricyclo[3.3.1.13,7]decane-1,3-diol, tricyclo[3.3.1.1~3,7~]decane-1,3-diol, MFCD00154013, 1,3-Adamantandiol; 1,3-Dihydroxyadamantane;, adamantan-1,3-diol, 1,3-adamantane diol, 1,3-adamantane-diol, (1s,3s,5s,7s)-adamantane-1,3-diol, 1,3-Adamantanediol #, 1, 3-dihydroxyadamantane, Oprea1_509718, SCHEMBL424418, SCHEMBL503327, SCHEMBL14791285, SCHEMBL15467155, SCHEMBL15858211, ALBB-013814, BCP33308, BBL012286, STK803145, AKOS001483023, AKOS016034998, AKOS037643343, CS-W001580, FD03749, 1,3-Adamantanediol;Adamantane-1,3-diol, 1,3-Adamantanediol, >=99.0% (GC), AS-14625, DS-13497, SY030302, A1531, ST45003587, EN300-121797, O10344, SR-01000396850, SR-01000396850-1, Z1509059210

1,3-Adamantanediol serves as a key intermediate in synthesizing adamantane-based pharmaceuticals, including antiviral and CNS-targeting drugs. Its rigid structure is exploited in polymer science to enhance thermal stability and mechanical strength of specialty resins. Researchers also use it to develop novel metal-organic frameworks (MOFs) and supramolecular architectures due to its directional bonding capabilities.

Safety and Hazards

GHS Hazard Statements

• H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
• H312 (50%): Harmful in contact with skin [Warning Acute toxicity, dermal]
• H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]
• H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
• H332 (50%): Harmful if inhaled [Warning Acute toxicity, inhalation]
• H335 (50%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

Precautionary Statements

• P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

Hazard Classes and Categories

• Acute Tox. 4 (50%)
• Acute Tox. 4 (50%)
• Skin Irrit. 2 (50%)
• Eye Irrit. 2A (50%)
• Acute Tox. 4 (50%)
• STOT SE 3 (50%)

If you are interested or have any questions, please contact us at support@atomfair.com

Disclaimer: Sold exclusively for laboratory research. Prohibited for commercial use, diagnostics, or human/animal applications. Buyers assume all compliance liability.