BUTANOIC ACID, 3-HYDROXY-4-IODO-, ETHYL ESTER, (S) (CAS 112100-39-7) — formula C6H11IO3, molecular weight 258.05; category organic chemicals.
| CAS Number | 112100-39-7 |
|---|---|
| Molecular Formula | C6H11IO3 |
| Molecular Weight | 258.05 |
| LogP | 0.9 |
| Category | Organic Chemicals |
BUTANOIC ACID, 3-HYDROXY-4-IODO-, ETHYL ESTER, (S) is a carbon-based organic compound with CAS registry number 112100-39-7 and molecular formula C6H11IO3 (molecular weight 258.05), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 112100-39-7
Its molecular formula C6H11IO3 comprises 6 C, 11 H, 1 I, 3 O atoms.
Also known as: BUTANOIC ACID, 3-HYDROXY-4-IODO-, ETHYL ESTER, (S) · 丁酸，3-羟基-4-碘-乙酯，(S)
Category: organic chemicals
The CAS registry number of BUTANOIC ACID, 3-HYDROXY-4-IODO-, ETHYL ESTER, (S) is 112100-39-7.
Molecular formula C6H11IO3, molecular weight 258.05.
It is also registered under: BUTANOIC ACID, 3-HYDROXY-4-IODO-, ETHYL ESTER, (S), 丁酸，3-羟基-4-碘-乙酯，(S).
Category: Organic Chemicals.
Independent reference data for BUTANOIC ACID, 3-HYDROXY-4-IODO-, ETHYL ESTER, (S) (CAS 112100-39-7), compiled from public chemistry databases.
| CAS Registry Number | 112100-39-7 |
|---|---|
| PubChem CID | 13778740 |
| Molecular formula | C6H11IO3 |
| IUPAC name | ethyl (3S)-3-hydroxy-4-iodobutanoate |
| Molecular Weight | 258.05 |
|---|---|
| XLogP3 | 0.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 5 |
| Exact Mass | 257.97529 |
| Monoisotopic Mass | 257.97529 |
| Topological Polar Surface Area | 46.5 |
| Heavy Atom Count | 10 |
112100-39-7; ethyl (3S)-3-hydroxy-4-iodobutanoate; RefChem:593107; 101-132-2; (S)-Ethyl 3-hydroxy-4-iodobutanoate; BUTANOIC ACID, 3-HYDROXY-4-IODO-, ETHYL ESTER, (S); MFCD00672874; Ethyl (S)-3-hydroxy-4-iodobutanoate; (S)-3-hydroxy-4-iodobutanoic acid ethyl ester; SCHEMBL2168521; SMWBHOKQXGBYJN-YFKPBYRVSA-N; Ethyl 3(S)-hydroxy-4-iodobutyrate; ethyl (S)-4-iodo-3-hydroxybutyrate; AKOS024463439; ethyl (S) -4-iodo-3-hydroxybutyrate; SY466261
| Reported hazard statements | H302 (100%), H315 (100%), H318 (100%), H335 (100%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
BUTANOIC ACID, 3-HYDROXY-4-IODO-, ETHYL ESTER, (S) · CAS 112100-39-7 · C6H11IO3.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 丁酸，3-羟基-4-碘-乙酯，(S)