| CAS Number | 1094218-30-0 |
| Catalog Number | AG007T6E(AGN-PC-0WBRDH) |
| Chemical Name | 1-(4-Bromophenyl)Cyclobutanamine |
| IUPAC Name | 1-(4-bromophenyl)cyclobutan-1-amine |
| InChI | InChI=1S/C10H12BrN/c11-9-4-2-8(3-5-9)10(12)6-1-7-10/h2-5H,1,6-7,12H2 |
| InChI Key | JAINAWVWUDTCFK-UHFFFAOYSA-N |
| MDL Number | MFCD09910041 |
| Molecular Formula | C10H12BrN |
| Molecular Weight | 226.1130 |
| SMILES | NC1(C2=CC=C(Br)C=C2)CCC1 |
| Synonyms | 1-(4-BROMOPHENYL)CYCLOBUTANAMINE,
1094218-30-0,
1-(4-bromophenyl)cyclobutan-1-amine,
SCHEMBL255382,
AC1Q50G2,
CTK8B9826,
DTXSID70655566,
ANW-63225,
MFCD09910041,
ZINC36379604,
AKOS009321777,
MCULE-9684968774,
NE21762,
AJ-92723,
SY180392,
TC-151970,
FT-0689691,
EN300-57336,
MFCD09910041 (95%),
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| Complexity | 157 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 225.015g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 226.117g/mol |
| Monoisotopic Mass | 225.015g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number