CS-1003918
Benzoic acid, 3-[[[(2S,4R)-4-hydroxy-2-pyrrolidinyl]carbonyl]amino]-, hydrochloride 1:1
Manufacturer: ChemScene
CAS Number: 444057-65-2
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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
C₁₂H₁₅ClN₂O₄
Molecular Weight
286.71
Synonyms
None
SMILES
C(NC1=CC(C(O)=O)=CC=C1)(=O)[C@@H]2C[C@@H](O)CN2.Cl
Tpsa
98.66
Logp
0.4679
H Acceptors
4
H Donors
4
Rotatable Bonds
3
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 444057-65-2 | | A2B Chem | -- |
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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: C₁₂H₁₅ClN₂O₄
Molecular Weight: 286.71
Synonyms: None
SMILES: C(NC1=CC(C(O)=O)=CC=C1)(=O)[C@@H]2C[C@@H](O)CN2.Cl
Tpsa: 98.66
Logp: 0.4679
H Acceptors: 4
H Donors: 4
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:
C₁₂H₁₅ClN₂O₄
Molecular Weight:
286.71
Synonyms:
None
SMILES:
C(NC1=CC(C(O)=O)=CC=C1)(=O)[C@@H]2C[C@@H](O)CN2.Cl
Tpsa:
98.66
Logp:
0.4679
H Acceptors:
4
H Donors:
4
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: C₄H₈O₃
Molecular Weight: 104.10
Synonyms: None
SMILES: OCC1OC1CO
Tpsa: 52.99
Logp: -1.2616
H Acceptors: 3
H Donors: 2
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:
C₄H₈O₃
Molecular Weight:
104.10
Synonyms:
None
SMILES:
OCC1OC1CO
Tpsa:
52.99
Logp:
-1.2616
H Acceptors:
3
H Donors:
2
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: C₈H₁₂O₄
Molecular Weight: 172.18
Synonyms: None
SMILES: O=C(O)C(=CCC(C)C)C(=O)O
Tpsa: 74.6
Logp: 1.1281
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₂O₄
Molecular Weight:
172.18
Synonyms:
None
SMILES:
O=C(O)C(=CCC(C)C)C(=O)O
Tpsa:
74.6
Logp:
1.1281
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₆O₄
Molecular Weight: 188.22
Synonyms: None
SMILES: O=C(O)C(C(=O)O)(CCC)C(C)C
Tpsa: 74.6
Logp: 1.5981
H Acceptors: 2
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:
C₉H₁₆O₄
Molecular Weight:
188.22
Synonyms:
None
SMILES:
O=C(O)C(C(=O)O)(CCC)C(C)C
Tpsa:
74.6
Logp:
1.5981
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
5