| CAS Number | 31656-62-9 |
| Catalog Number | AG00BZL5(AGN-PC-0R719M) |
| Chemical Name | Benzamide-15N |
| IUPAC Name | (15N)benzamide |
| InChI | InChI=1S/C7H7NO/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H2,8,9)/i8+1 |
| InChI Key | KXDAEFPNCMNJSK-VJJZLTLGSA-N |
| MDL Number | MFCD00084200 |
| Molecular Formula | C7H7NO |
| Molecular Weight | 122.1300 |
| SMILES | C([15NH2])(=O)C1=CC=CC=C1 |
| Synonyms | Benzamide-15N,
31656-62-9,
(15N)Benzamide,
SCHEMBL1332331,
DTXSID40479998,
Benzamide-15N, 98 atom % 15N,
AKOS015889516,
ACM31656629,
J-018506,
I01-19669,
Benzamide-15N solution, NMR reference standard, 98 atom % 15N, 2% in DMSO-d6 ("100%", 99.96 atom % D), chromium(III) acetylacetonate 0.2 %, NMR tube size 6.5 mm x 8 in.,
Benzamide,
Benzamide 15N,
CS-T-48626,
|
| Complexity | 106 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 122.05g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 1 |
| Molecular Weight | 122.132g/mol |
| Monoisotopic Mass | 122.05g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 43.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number