Boc-(R)-3-amino-4-(4-cyano-phenyl)-butyric acid (CAS 269726-86-5) — formula C16H20N2O4, molecular weight 304.34; category organic chemicals.
| CAS Number | 269726-86-5 |
|---|---|
| Molecular Formula | C16H20N2O4 |
| Molecular Weight | 304.34 |
| LogP | 2.2 |
| Category | Organic Chemicals |
Boc-(R)-3-amino-4-(4-cyano-phenyl)-butyric acid is a carbon-based organic compound with CAS registry number 269726-86-5 and molecular formula C16H20N2O4 (molecular weight 304.34), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 269726-86-5
Its molecular formula C16H20N2O4 comprises 16 C, 20 H, 2 N, 4 O atoms.
Also known as: Boc-(R)-3-amino-4-(4-cyano-phenyl)-butyric acid · Boc-(R)-3-氨基-4-(4-氰基-苯基)-丁酸
Category: organic chemicals
The CAS registry number of Boc-(R)-3-amino-4-(4-cyano-phenyl)-butyric acid is 269726-86-5.
Molecular formula C16H20N2O4, molecular weight 304.34.
It is also registered under: Boc-(R)-3-amino-4-(4-cyano-phenyl)-butyric acid, Boc-(R)-3-氨基-4-(4-氰基-苯基)-丁酸.
Category: Organic Chemicals.
Independent reference data for Boc-(R)-3-amino-4-(4-cyano-phenyl)-butyric acid (CAS 269726-86-5), compiled from public chemistry databases.
| CAS Registry Number | 269726-86-5 |
|---|---|
| PubChem CID | 7009835 |
| Molecular formula | C16H20N2O4 |
| IUPAC name | (3R)-4-(4-cyanophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid |
| Molecular Weight | 304.34 |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 7 |
| Exact Mass | 304.14230712 |
| Monoisotopic Mass | 304.14230712 |
| Topological Polar Surface Area | 99.4 |
| Heavy Atom Count | 22 |
(3R)-3-{[(tert-butoxy)carbonyl]amino}-4-(4-cyanophenyl)butanoic acid; (3R)-3-(((tert-butoxy)carbonyl)amino)-4-(4-cyanophenyl)butanoic acid; RefChem:400808; 971-427-6; 269726-86-5; (R)-3-((tert-butoxycarbonyl)amino)-4-(4-cyanophenyl)butanoic acid; Boc-(R)-3-Amino-4-(4-cyano-phenyl)-butyric acid; MFCD01860981; (R)-Boc-4-cyano-|A-Homophe-OH; (3R)-4-(4-cyanophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid; (R)-3-(Boc-amino)-4-(4-cyanophenyl)butanoic Acid; (3R)-3-[(tert-butoxycarbonyl)amino]-4-(4-cyanophenyl)butanoic acid; Boc-D-beta-HPhe(4-CN)-OH; SCHEMBL18920601; DTXSID801150305; UKA72686
| Reported hazard statements | H302 (100%), H312 (100%), H315 (100%), H319 (100%), H332 (100%), H335 (100%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]
Boc-(R)-3-amino-4-(4-cyano-phenyl)-butyric acid · CAS 269726-86-5 · C16H20N2O4.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.