| CAS Number | 30830-25-2 |
| Catalog Number | AG0031G7(AGN-PC-00O2L6) |
| Chemical Name | Cyclobutanone, 3-methoxy- |
| IUPAC Name | 3-methoxycyclobutan-1-one |
| InChI | InChI=1S/C5H8O2/c1-7-5-2-4(6)3-5/h5H,2-3H2,1H3 |
| InChI Key | LZKSSLYIICHJEO-UHFFFAOYSA-N |
| MDL Number | MFCD20266830 |
| Molecular Formula | C5H8O2 |
| Molecular Weight | 100.1158 |
| SMILES | COC1CC(C1)=O |
| Synonyms | 3-Methoxycyclobutanone,
3-methoxycyclobutan-1-one,
30830-25-2,
Cyclobutanone, 3-methoxy-,
3-METHOXYCYCLOBUTANON,
3alpha-Methoxycyclobutanone,
SCHEMBL16885218,
KS-000004BM,
MFCD20266830,
ZINC80720165,
AKOS015711577,
NE46043,
SB11270,
BS-12784,
SC-69753,
AJ-123989,
CS-0051289,
FT-0703096,
3| inverted exclamation mark-METHOXYCYCLOBUTANONE,
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| Complexity | 80.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 100.052g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 100.117g/mol |
| Monoisotopic Mass | 100.052g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number