CS-0014631
(R)-ethyl 2-amino-4-fluoro-4-methylpentanoate (S)-1-(tert-butoxycarbonyl)pyrrolidine-2-carboxylate
Manufacturer: ChemScene
CAS Number: None
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₈H₃₃FN₂O₆
Molecular Weight
392.46
Synonyms
None
SMILES
N[C@H](CC(C)(F)C)C(OCC)=O.O=C(OC(C)(C)C)N1CCC[C@H]1C(O)=O
Tpsa
119.16
Logp
2.4855
H Acceptors
6
H Donors
2
Rotatable Bonds
5
Other Options
...
SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₃₃FN₂O₆
Molecular Weight: 392.46
Synonyms: None
SMILES: N[C@H](CC(C)(F)C)C(OCC)=O.O=C(OC(C)(C)C)N1CCC[C@H]1C(O)=O
Tpsa: 119.16
Logp: 2.4855
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₃₃FN₂O₆
Molecular Weight:
392.46
Synonyms:
None
SMILES:
N[C@H](CC(C)(F)C)C(OCC)=O.O=C(OC(C)(C)C)N1CCC[C@H]1C(O)=O
Tpsa:
119.16
Logp:
2.4855
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
5
Purity: 98%
MDL No: MFCD30533097
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₃H₄₆F₄N₂O₄S
Molecular Weight: 642.79
Synonyms: None
SMILES: O=S(C1=CC=C(C2=CC=C([C@@H](C(F)(F)F)N[C@@H](CC(C)(F)C)C(O)=O)C=C2)C=C1)(C)=O.C3(NC4CCCCC4)CCCCC3
Tpsa: 95.5
Logp: 7.7829
H Acceptors: 5
H Donors: 3
Rotatable Bonds: 10
Purity:
98%
MDL No:
MFCD30533097
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₃H₄₆F₄N₂O₄S
Molecular Weight:
642.79
Synonyms:
None
SMILES:
O=S(C1=CC=C(C2=CC=C([C@@H](C(F)(F)F)N[C@@H](CC(C)(F)C)C(O)=O)C=C2)C=C1)(C)=O.C3(NC4CCCCC4)CCCCC3
Tpsa:
95.5
Logp:
7.7829
H Acceptors:
5
H Donors:
3
Rotatable Bonds:
10
Purity: 98%
MDL No: None
Storage: 4°C, sealed storage, away from moisture
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₃H₃₄N₇Na₂O₇P
Molecular Weight: 717.62
Synonyms: None
SMILES: C=CCN1CC(N([C@@H](CC2=CC=C(OP(O[Na])(O[Na])=O)C=C2)C(N(CC3=CC=CC4=CN(C)N=C43)C5)=O)[C@H]5N1C(NCC6=CC=CC=C6)=O)=O
Tpsa: 138.78
Logp: 2.997
H Acceptors: 10
H Donors: 1
Rotatable Bonds: 12
Purity:
98%
MDL No:
None
Storage:
4°C, sealed storage, away from moisture
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₃H₃₄N₇Na₂O₇P
Molecular Weight:
717.62
Synonyms:
None
SMILES:
C=CCN1CC(N([C@@H](CC2=CC=C(OP(O[Na])(O[Na])=O)C=C2)C(N(CC3=CC=CC4=CN(C)N=C43)C5)=O)[C@H]5N1C(NCC6=CC=CC=C6)=O)=O
Tpsa:
138.78
Logp:
2.997
H Acceptors:
10
H Donors:
1
Rotatable Bonds:
12
Purity: 98%
MDL No: MFCD00671476
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₇ClO₂
Molecular Weight: 180.67
Synonyms: 4-Chloro-1,1-diethoxybutane; 4-Chlorobutanal diethyl acetal; 4-Chlorobutyraldehyde diethyl acetal; NSC 96467; 4-CHLORO BUTANAL DIETHYL ACETAL
SMILES: CCOC(OCC)CCCCl
Tpsa: 18.46
Logp: 2.4045
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 7
Purity:
98%
MDL No:
MFCD00671476
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₇ClO₂
Molecular Weight:
180.67
Synonyms:
4-Chloro-1,1-diethoxybutane; 4-Chlorobutanal diethyl acetal; 4-Chlorobutyraldehyde diethyl acetal; NSC 96467; 4-CHLORO BUTANAL DIETHYL ACETAL
SMILES:
CCOC(OCC)CCCCl
Tpsa:
18.46
Logp:
2.4045
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
7