CS-0496123
(2S,4S)-4-(3-fluorobenzyl)pyrrolidine-2-carboxylic acid hydrochloride
Manufacturer: ChemScene
CAS Number: 686766-31-4
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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
C₁₂H₁₅ClFNO₂
Molecular Weight
259.70
Synonyms
None
SMILES
Cl.FC1C=C(C=CC=1)C[C@H]2C[C@@H](C(O)=O)NC2
Tpsa
49.33
Logp
1.8527
H Acceptors
2
H Donors
2
Rotatable Bonds
3
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SAFETY INFORMATION
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: C₁₂H₁₅ClFNO₂
Molecular Weight: 259.70
Synonyms: None
SMILES: Cl.FC1C=C(C=CC=1)C[C@H]2C[C@@H](C(O)=O)NC2
Tpsa: 49.33
Logp: 1.8527
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₅ClFNO₂
Molecular Weight:
259.70
Synonyms:
None
SMILES:
Cl.FC1C=C(C=CC=1)C[C@H]2C[C@@H](C(O)=O)NC2
Tpsa:
49.33
Logp:
1.8527
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₂₅NO₆
Molecular Weight: 327.37
Synonyms: None
SMILES: COC(=O)C1=CN(C(C1)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C
Tpsa: 82.14
Logp: 2.3944
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₂₅NO₆
Molecular Weight:
327.37
Synonyms:
None
SMILES:
COC(=O)C1=CN(C(C1)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C
Tpsa:
82.14
Logp:
2.3944
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₂₇NO₆
Molecular Weight: 329.39
Synonyms: None
SMILES: COC(=O)C1CN(C(=O)OC(C)(C)C)C(C1)C(=O)OC(C)(C)C
Tpsa: 82.14
Logp: 2.1267
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₂₇NO₆
Molecular Weight:
329.39
Synonyms:
None
SMILES:
COC(=O)C1CN(C(=O)OC(C)(C)C)C(C1)C(=O)OC(C)(C)C
Tpsa:
82.14
Logp:
2.1267
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₉NO₆
Molecular Weight: 273.28
Synonyms: 1,2,4-Pyrrolidinetricarboxylic acid, 1-(1,1-dimethylethyl) 4-methyl ester
SMILES: COC(=O)C1CC(N(C1)C(=O)OC(C)(C)C)C(O)=O
Tpsa: 93.14
Logp: 0.8696
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₉NO₆
Molecular Weight:
273.28
Synonyms:
1,2,4-Pyrrolidinetricarboxylic acid, 1-(1,1-dimethylethyl) 4-methyl ester
SMILES:
COC(=O)C1CC(N(C1)C(=O)OC(C)(C)C)C(O)=O
Tpsa:
93.14
Logp:
0.8696
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2