| CAS Number | 65338-30-9 |
| Catalog Number | AG00IBHD(AGN-PC-02N5OF) |
| Chemical Name | 1-Methylcyclobutane-1-carbaldehyde |
| IUPAC Name | 1-methylcyclobutane-1-carbaldehyde |
| InChI | InChI=1S/C6H10O/c1-6(5-7)3-2-4-6/h5H,2-4H2,1H3 |
| InChI Key | NCJXPECBGWEDFS-UHFFFAOYSA-N |
| MDL Number | MFCD18533416 |
| Molecular Formula | C6H10O |
| Molecular Weight | 98.1430 |
| SMILES | CC1(C=O)CCC1 |
| Synonyms | 1-methylcyclobutane-1-carbaldehyde,
1-methylcyclobutanecarbaldehyde,
65338-30-9,
Cyclobutanecarboxaldehyde, 1-methyl-,
CTK1J7505,
DTXSID80602824,
NCJXPECBGWEDFS-UHFFFAOYSA-N,
MFCD18533416,
ZINC59144219,
AKOS006373722,
NE61589,
FT-0719080,
1-methylcyclobutanecarboxaldehyde,
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| Complexity | 82.2 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 98.073g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 98.145g/mol |
| Monoisotopic Mass | 98.073g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number