Hexahydro-2,5-methanopentalene-3a(1H)-carboxylic acid
Properties
- Molecular formula
- C10H14O2
- Molar mass
- 166.22 g/mol
- Exact mass
- 166.0994 Da
- Melting point
- 103–105 °C
- logP
- 1.90Crippen estimate
- Polar surface area
- 37.3 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 1
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation83.3% of notifiers
Aggregated from 6 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
16200-53-6SMILES
O=C(O)C12CC3CC(CC1C3)C2InChIKey
RXUUYFUQAGICCD-UHFFFAOYSA-NInChI
InChI=1S/C10H14O2/c11-9(12)10-4-6-1-7(5-10)3-8(10)2-6/h6-8H,1-5H2,(H,11,12)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
3 names
- 2,5-Methanopentalene-3a(1H)-carboxylic acid, hexahydro-
- 3-Noradamantanecarboxylic acid
- Tricyclo[3.3.1.03,7]nonane-3-carboxylic acid
Work with Hexahydro-2,5-methanopentalene-3a(1H)-carboxylic acid
Similar compounds
1-Adamantanecarboxylic acid828-51-359 % similar
1,3-Adamantanedicarboxylic acid39269-10-850 % similar
2-Aminobicyclo(2,2,1)heptane-2-carboxylic acid20448-79-746 % similar
3-Hydroxyadamantane-1-carboxylic acid42711-75-143 % similar
3-Bromoadamantane-1-carboxylic acid21816-08-042 % similar
3-Chloroadamantane-1-carboxylic acid34859-74-042 % similar
1-Adamantaneacetic acid4942-47-641 % similar
1-Fluoro-cyclopropanecarboxylic acid137081-41-537 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.