Fmoc-L-Serine
- Iupac Name：(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-hydroxypropanoic acid
- CAS No.: 73724-45-5
- Molecular Weight：327.34
- Modify Date.: 2023-03-06 11:23
- Introduction:
Light yellow powder
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1. Names and Identifiers
- 1.1 Name
- Fmoc-L-Serine
- 1.2 Synonyms
(2S)-2-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-3-hydroxypropanoate (S)-2-(((9H-fluoren-9-yl)Methoxy)carbonylaMino)-3-hydroxypropanoic acid FMoc-Ser.H2O Fmoc-Ser-OH FMoc-Ser-OH (FMoc-L-Serine) L-Serine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-, ion(1-) L-Serine-d3-N-FMOC L-SERINE-N-FMOC (13C3,15N) N-(9-Fluorenylmethoxycarbonyl)-L-serine N-Fmoc-L-serine N-Fmoc-L-serineFmoc-Ser-OH
- 1.3 CAS No.
- 73724-45-5
- 1.4 CID
- 6541433
- 1.5 Molecular Formula
- C18H17NO5 (isomer)
- 1.6 Inchi
- InChI=1S/C18H17NO5/c20-9-16(17(21)22)19-18(23)24-10-15-13-7-3-1-5-11(13)12-6-2-4-8-14(12)15/h1-8,15-16,20H,9-10H2,(H,19,23)(H,21,22)/t16-/m0/s1
- 1.7 InChkey
- JZTKZVJMSCONAK-INIZCTEOSA-N
- 1.8 Canonical Smiles
- C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC(CO)C(=O)O
- 1.9 Isomers Smiles
- C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CO)C(=O)O
2. Properties
- 2.1 Density
- 1.362
- 2.1 Melting point
- 104-106℃
- 2.1 Boiling point
- 599.3 °C at 760 mmHg
- 2.1 Refractive index
- -12.5 ° (C=1, DMF)
- 2.1 Flash Point
- 316.2 °C
- 2.1 Precise Quality
- 327.11100
- 2.1 PSA
- 95.86000
- 2.1 logP
- 2.36150
- 2.1 Appearance
- White to off-white crystalline powder
- 2.2 Storage
- Keep Cold.
- 2.3 Chemical Properties
- Light yellow powder Fmoc-L-SerineSupplier
- 2.4 pKa
- 3.51±0.10(Predicted)
- 2.5 Water Solubility
- Appearance:White to off-white crystalline powder
Transport Information: OTH
Hazard Symbols:Not regulated UN NO.
particular:particular
- 2.6 StorageTemp
- 2-8°C
3. Safety and Handling
- 3.1 Hazard Codes
- Xi
- 3.1 Risk Statements
- R36/37/38
- 3.1 Safety Statements
- S22;S24/25
- 3.1 Hazard Declaration
- H319
- 3.1 RIDADR
- OTH
- 3.1 Caution Statement
- P201, P202, P261, P264, P271, P280, P281, P304+P340, P305+P351+P338, P308+P313, P312, P337+P313, P403+P233, P405, P501
- 3.1 WGK Germany
- 3
4. MSDS
2.Hazard identification
2.1 Classification of the substance or mixture
Eye irritation, Category 2
Specific target organ toxicity \u2013 single exposure, Category 3
Carcinogenicity, Category 2
2.2 GHS label elements, including precautionary statements
| Pictogram(s) |   |
| Signal word | Warning |
| Hazard statement(s) | H319 Causes serious eye irritation H335 May cause respiratory irritation H351 Suspected of causing cancer |
| Precautionary statement(s) | |
| Prevention | P264 Wash ... thoroughly after handling. P280 Wear protective gloves/protective clothing/eye protection/face protection. P261 Avoid breathing dust/fume/gas/mist/vapours/spray. P271 Use only outdoors or in a well-ventilated area. P201 Obtain special instructions before use. P202 Do not handle until all safety precautions have been read and understood. |
| Response | P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing. P337+P313 If eye irritation persists: Get medical advice/attention. P304+P340 IF INHALED: Remove person to fresh air and keep comfortable for breathing. P312 Call a POISON CENTER/doctor/\u2026if you feel unwell. P308+P313 IF exposed or concerned: Get medical advice/ attention. |
| Storage | P403+P233 Store in a well-ventilated place. Keep container tightly closed. P405 Store locked up. |
| Disposal | P501 Dispose of contents/container to ... |
2.3 Other hazards which do not result in classification
none
5. Synthesis Route
73724-45-5Total: 16 Synthesis Route
7. Computational chemical data
- Molecular Weight: 327.34g/mol
- Molecular Formula: C18H17NO5
- Compound Is Canonicalized: True
- XLogP3-AA: 2
- Exact Mass: 327.11067264
- Monoisotopic Mass: 327.11067264
- Complexity: 446
- Rotatable Bond Count: 6
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Topological Polar Surface Area: 95.9
- Heavy Atom Count: 24
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count: 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Isotope Atom Count: 0
- Covalently-Bonded Unit Count: 1
- CACTVS Substructure Key Fingerprint: AAADceB6OAAAAAAAAAAAAAAAAAAAAYAAAAAwYAAAAAAAAGABQAAAHgAQCAAADSjhmAYwCILABgCIAiDSGAACAAAgAAAIiIGIAIkKMCaAETCIYAAl9gEYiAeAwPAOgAAAAAAQAAAAAAAAACAAAQAACAAAAA==
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9. Realated Product Infomation
skype
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