| CAS Number | 263403-78-7 |
| Catalog Number | AG002STQ(AGN-PC-0078HE) |
| Chemical Name | tert-Butyl N-(1-phenylcyclopropyl)carbamate |
| IUPAC Name | tert-butyl N-(1-phenylcyclopropyl)carbamate |
| InChI | InChI=1S/C14H19NO2/c1-13(2,3)17-12(16)15-14(9-10-14)11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3,(H,15,16) |
| InChI Key | LOYKYRSYEAFKTO-UHFFFAOYSA-N |
| MDL Number | MFCD24393293 |
| Molecular Formula | C14H19NO2 |
| Molecular Weight | 233.3062 |
| SMILES | O=C(NC1(CC1)c1ccccc1)OC(C)(C)C |
| Synonyms | tert-Butyl (1-phenylcyclopropyl)carbamate,
263403-78-7,
Tert-butyl N-(1-phenylcyclopropyl)carbamate,
SCHEMBL2554955,
LOYKYRSYEAFKTO-UHFFFAOYSA-N,
ZINC95930429,
AKOS022178066,
tert-butyl(1-phenylcyclopropyl)carbamate,
AJ-136334,
O-t-butyl-N-(1-phenylcyclopropyl)carbamate,
Carbamic acid, (1-phenylcyclopropyl)-, 1,1-dimethylethyl ester (9CI),
CID11345321,
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| Complexity | 283 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 233.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 233.311g/mol |
| Monoisotopic Mass | 233.142g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 38.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number