| CAS Number | 58885-90-8 |
| Catalog Number | AG00F1YF(AGN-PC-0WB2W9) |
| Chemical Name | 2-(1-aminocyclobutyl)acetic acid |
| IUPAC Name | 2-(1-aminocyclobutyl)acetic acid |
| InChI | InChI=1S/C6H11NO2/c7-6(2-1-3-6)4-5(8)9/h1-4,7H2,(H,8,9) |
| InChI Key | NQFXADOWWKULAR-UHFFFAOYSA-N |
| MDL Number | MFCD13249387 |
| Molecular Formula | C6H11NO2 |
| Molecular Weight | 129.1570 |
| SMILES | OC(=O)CC1(N)CCC1 |
| Synonyms | 2-(1-aminocyclobutyl)acetic acid,
58885-90-8,
(1-aminocyclobutyl)acetic acid,
(1-AMINO-CYCLOBUTYL)-ACETIC ACID,
SCHEMBL430341,
NQFXADOWWKULAR-UHFFFAOYSA-N,
KS-00002BQ3,
MFCD13249387,
ZINC72266515,
AKOS006349167,
MCULE-7887308813,
SB22550,
TS-7200,
CS-0052330,
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| Complexity | 129 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 129.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 129.159g/mol |
| Monoisotopic Mass | 129.079g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 63.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -2.2 |
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Certificate of Analysis
Lot Number