Butanoic acid, 3-[(phenylmethyl)amino]- (CAS 91246-78-5) — formula C11H15NO2, molecular weight 193.24; category organic chemicals.
Butanoic acid, 3-[(phenylmethyl)amino]- is a carbon-based organic compound with CAS registry number 91246-78-5 and molecular formula C11H15NO2 (molecular weight 193.24), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 91246-78-5
Its molecular formula C11H15NO2 comprises 11 C, 15 H, 1 N, 2 O atoms.
Also known as: Butanoic acid, 3-[(phenylmethyl)amino]- · N-苄基-RS-3-氨基丁酸
Category: organic chemicals
The CAS registry number of Butanoic acid, 3-[(phenylmethyl)amino]- is 91246-78-5.
Molecular formula C11H15NO2, molecular weight 193.24.
It is also registered under: Butanoic acid, 3-[(phenylmethyl)amino]-, N-苄基-RS-3-氨基丁酸.
Category: Organic Chemicals.
Public-database records for Butanoic acid, 3-[(phenylmethyl)amino]- (CAS 91246-78-5), reproduced here for independent cross-checking.
| CAS 号 | 91246-78-5 |
|---|---|
| PubChem CID | 2733682 |
| 分子式 | C11H15NO2 |
| IUPAC 名称 | 3-(benzylamino)butanoic acid |
| UNII（FDA） | ST50405919 |
3-(benzylamino)butanoic acid; 91246-78-5; DTXSID50369972; 3-[benzylamino]butanoic acid; RefChem:275116; DTXCID80321008; 3-BENZYLAMINOBUTYRIC ACID; MFCD00045920; Butanoic acid, 3-[(phenylmethyl)amino]-; 3-(benzylamino)butanoicacid; 3-(benzylamino)-butyric acid; SCHEMBL2852187; 3-(N-benzylamino) butyric acid; QIXZNMWEYBPTEQ-UHFFFAOYSA-N; AKOS009156610; BS-33125
| 分子量 | 193.24 |
|---|---|
| XLogP3 | -1.1 |
| 氢键供体数 | 2 |
| 氢键受体数 | 3 |
| 可旋转键数 | 5 |
| 精确质量 | 193.110278721 |
| 单同位素质量 | 193.110278721 |
| 拓扑极性表面积 | 49.3 |
| 重原子数 | 14 |
| 形式电荷 | 0 |
N-苄基-RS-3-氨基丁酸 · CAS 91246-78-5 · C11H15NO2. UNII ST50405919.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd. · Reply within one business day.