1-Benzyl-3-azetidinecarboxylic acid (CAS 94985-27-0) — formula C11H13NO2, molecular weight 191.23; category organic chemicals.
| CAS Number | 94985-27-0 |
|---|---|
| Molecular Formula | C11H13NO2 |
| Molecular Weight | 191.23 |
| LogP | -1.2 |
| Category | Organic Chemicals |
1-Benzyl-3-azetidinecarboxylic acid is a carbon-based organic compound with CAS registry number 94985-27-0 and molecular formula C11H13NO2 (molecular weight 191.23), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 94985-27-0
Its molecular formula C11H13NO2 comprises 11 C, 13 H, 1 N, 2 O atoms.
Also known as: 1-Benzyl-3-azetidinecarboxylic acid · 1-苄基-3-氮杂环丁烷甲酸
Category: organic chemicals
The CAS registry number of 1-Benzyl-3-azetidinecarboxylic acid is 94985-27-0.
Molecular formula C11H13NO2, molecular weight 191.23.
It is also registered under: 1-Benzyl-3-azetidinecarboxylic acid, 1-苄基-3-氮杂环丁烷甲酸.
Category: Organic Chemicals.
Independent reference data for 1-Benzyl-3-azetidinecarboxylic acid (CAS 94985-27-0), compiled from public chemistry databases.
| CAS Registry Number | 94985-27-0 |
|---|---|
| PubChem CID | 3161318 |
| Molecular formula | C11H13NO2 |
| IUPAC name | 1-benzylazetidine-3-carboxylic acid |
| UNII (FDA) | HMS1697O12 |
| Molecular Weight | 191.23 |
|---|---|
| XLogP3 | -1.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 191.094628657 |
| Monoisotopic Mass | 191.094628657 |
| Topological Polar Surface Area | 40.5 |
| Heavy Atom Count | 14 |
1-benzylazetidine-3-carboxylic acid; 94985-27-0; 1-Benzyl-azetidine-3-carboxylic acid; 1-benzyl-3-azetidinecarboxylic acid; 3-Azetidinecarboxylic acid, 1-(phenylmethyl)-; MFCD06752277; n-benzylazetidine-3-carboxylic acid; 1-Benzylazetidine-3-carboxylicacid; N-benzyl-3-carboxy-azetidine; SCHEMBL565212; SCHEMBL1661977; SCHEMBL1663597; DTXSID10915196; XVFKOLZJNKMHNL-UHFFFAOYSA-N; HMS1697O12; n-benzyl-azetidine-3-carboxylic acid
| Reported hazard statements | H315 (100%), H319 (100%), H335 (100%) |
|---|
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
1-Benzyl-3-azetidinecarboxylic acid · CAS 94985-27-0 · C11H13NO2. UNII HMS1697O12.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 1-苄基-3-氮杂环丁烷甲酸