| CAS Number | 103489-33-4 |
| Catalog Number | AG008XFB(AGN-PC-00N5QO) |
| Chemical Name | 4-Azidobenzenebutanoic acid |
| IUPAC Name | 4-(4-azidophenyl)butanoic acid |
| InChI | InChI=1S/C10H11N3O2/c11-13-12-9-6-4-8(5-7-9)2-1-3-10(14)15/h4-7H,1-3H2,(H,14,15) |
| InChI Key | IXJMMVGNIFCPFH-UHFFFAOYSA-N |
| MDL Number | MFCD00798800 |
| Molecular Formula | C10H11N3O2 |
| Molecular Weight | 205.2132 |
| SMILES | OC(=O)CCCc1ccc(cc1)N=[N+]=[N-] |
| Synonyms | 4-(4-AZIDOPHENYL)BUTYRIC ACID,
103489-33-4,
4-(4-azidophenyl)butanoic acid,
Benzenebutanoic acid,4-azido-,
ACMC-20m6bs,
SCHEMBL14720056,
CTK4A2141,
DTXSID90544302,
5431AH,
MFCD00798800,
ZINC15722191,
AKOS030255364,
CC-16474,
DB-040459,
FT-0642533,
K-0376,
C-10145,
Benzenebutanoic acid, 4-azido-,
C10H11N3O2,
|
| Complexity | 253 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.085g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 205.217g/mol |
| Monoisotopic Mass | 205.085g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 51.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number