| CAS Number | 1132814-49-3 |
| Catalog Number | AG00IL4E(AGN-PC-0WO8VO) |
| Chemical Name | 2-(1-aminocyclobutyl)ethan-1-ol |
| IUPAC Name | 2-(1-aminocyclobutyl)ethanol |
| InChI | InChI=1S/C6H13NO/c7-6(4-5-8)2-1-3-6/h8H,1-5,7H2 |
| InChI Key | AKJLCLKIEWILAH-UHFFFAOYSA-N |
| MDL Number | MFCD19215486 |
| Molecular Formula | C6H13NO |
| Molecular Weight | 115.1735 |
| SMILES | NC1(CCO)CCC1 |
| Synonyms | 2-(1-aminocyclobutyl)ethan-1-ol,
1132814-49-3,
2-(1-aminocyclobutyl)ethanol,
1-amino-1-(2-hydroxyethyl)cyclobutane,
SCHEMBL1185653,
AKJLCLKIEWILAH-UHFFFAOYSA-N,
KS-000006ED,
MFCD19215486,
ZINC72266673,
AKOS006348795,
MCULE-6016883146,
SB22548,
AS-48614,
CS-0044856,
2-(1-Aminocyclobutyl)ethanol hydrochloride,
1375473-21-4,
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| Complexity | 78.6 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 115.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 115.176g/mol |
| Monoisotopic Mass | 115.1g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number