| CAS Number | 1810070-03-1 |
| Catalog Number | AG0022K7(AGN-PC-0WCXGY) |
| Chemical Name | Bicyclo[4.2.0]octa-1,3,5-trien-3-amine, hydrochloride (1:1) |
| IUPAC Name | bicyclo[4.2.0]octa-1(6),2,4-trien-3-amine;hydrochloride |
| InChI | InChI=1S/C8H9N.ClH/c9-8-4-3-6-1-2-7(6)5-8;/h3-5H,1-2,9H2;1H |
| InChI Key | LHUAGIGSYLCNAS-UHFFFAOYSA-N |
| MDL Number | MFCD28133538 |
| Molecular Formula | C8H10ClN |
| Molecular Weight | 155.6247 |
| SMILES | NC1=CC=C2CCC2=C1.[H]Cl |
| Synonyms | 1810070-03-1,
4-Amino-benzocyclobutane HCl,
Bicyclo[4.2.0]octa-1,3,5-trien-3-amine hydrochloride,
4-Aminobenzocyclobutane hydrochloride,
MFCD28133538,
AS-38679,
Bicyclo[4.2.0]octa-1,3,5-trien-3-amine, hydrochloride (1:1),
55716-66-0,
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| Complexity | 111 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 155.05g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 155.625g/mol |
| Monoisotopic Mass | 155.05g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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