| CAS Number | 1332765-79-3 |
| Catalog Number | AG0014II(AGN-PC-0WNGZF) |
| Chemical Name | 3-Oxetanamine, 3-(3-bromophenyl)-, hydrochloride (1:1) |
| IUPAC Name | 3-(3-bromophenyl)oxetan-3-amine;hydrochloride |
| InChI | InChI=1S/C9H10BrNO.ClH/c10-8-3-1-2-7(4-8)9(11)5-12-6-9;/h1-4H,5-6,11H2;1H |
| InChI Key | AVFGETQERDGLCM-UHFFFAOYSA-N |
| MDL Number | MFCD19381731 |
| Molecular Formula | C9H11BrClNO |
| Molecular Weight | 264.5467 |
| SMILES | NC1(C2=CC=CC(Br)=C2)COC1.[H]Cl |
| Synonyms | 3-(3-Bromophenyl)oxetan-3-amine hydrochloride,
1332765-79-3,
1332920-63-4,
3-Amino-3-(3-bromophenyl)oxetane hydrochloride,
3-(3-Bromophenyl)oxetan-3-amine HCl,
SCHEMBL19280128,
ZX-AT013415,
MFCD19381731,
AKOS024438480,
OR61147,
PB11412,
SB20183,
KS-0000070M,
AS-32718,
CS-0051765,
3-Amino-3-(3-bromophenyl)oxetanehydrochloride,
Q-4269,
3-(3-Aminooxetan-3-yl)bromobenzene hydrochloride,
3-Oxetanamine, 3-(3-bromophenyl)-, hydrochloride (1:1),
|
| Complexity | 170 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 262.971g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 264.547g/mol |
| Monoisotopic Mass | 262.971g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number