Bicyclo[3.1.0]hexane-6-carboxylic Acid (endo/exo Mixture) - CAS 16650-37-6
Catalog: |
BB073351 |
Product Name: |
Bicyclo[3.1.0]hexane-6-carboxylic Acid (endo/exo Mixture) |
CAS: |
16650-37-6 |
Synonyms: |
bicyclo[3.1.0]hexane-6-carboxylic acid; Bicyclo[3.1.0]hexane-6-carboxylic Acid (endo/exo Mixture); Bicyclo[3.1.0]hexane-6-carboxylicacid; exo-Bicyclo(3.1.0)hexane-6-carboxylic acid |
IUPAC Name: | bicyclo[3.1.0]hexane-6-carboxylic acid |
Molecular Weight: | 126.15 |
Molecular Formula: | C7H10O2 |
Canonical SMILES: | C1CC2C(C1)C2C(=O)O |
InChI: | InChI=1S/C7H10O2/c8-7(9)6-4-2-1-3-5(4)6/h4-6H,1-3H2,(H,8,9) |
InChI Key: | KPNFHMCCBRGOKU-UHFFFAOYSA-N |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 143 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 126.068079557 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 126.068079557 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 37.3Ų |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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