| CAS Number | 1350821-95-2 |
| Catalog Number | AG00ILFN(AGN-PC-0WRAIF) |
| Chemical Name | Methyl 4-(hydroxymethyl)bicyclo[2.2.1]heptane-1-carboxylate |
| IUPAC Name | methyl 4-(hydroxymethyl)bicyclo[2.2.1]heptane-1-carboxylate |
| InChI | InChI=1S/C10H16O3/c1-13-8(12)10-4-2-9(6-10,7-11)3-5-10/h11H,2-7H2,1H3 |
| InChI Key | SUBCPWAUFQPRLU-UHFFFAOYSA-N |
| MDL Number | MFCD26727798 |
| Molecular Formula | C10H16O3 |
| Molecular Weight | 184.2322 |
| SMILES | COC(=O)C12CCC(C2)(CC1)CO |
| Synonyms | methyl 4-(hydroxymethyl)bicyclo[2.2.1]heptane-1-carboxylate,
1350821-95-2,
SCHEMBL16055077,
SUBCPWAUFQPRLU-UHFFFAOYSA-N,
ZINC107264449,
CS-0049066,
methyl 4-(hydroxymethyl)norbornane-1-carboxylate,
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| Complexity | 226 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 184.11g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 184.235g/mol |
| Monoisotopic Mass | 184.11g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number