CS-0533316
(S)-Methyl 4-nitro-3-(((tetrahydrofuran-2-yl)methyl)amino)benzoate
Manufacturer: ChemScene
CAS Number: 2641114-72-7
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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
C₁₃H₁₆N₂O₅
Molecular Weight
280.28
Synonyms
None
SMILES
O=C(OC)C1=CC=C([N+]([O-])=O)C(NC[C@H]2OCCC2)=C1
Tpsa
90.7
Logp
1.9723
H Acceptors
6
H Donors
1
Rotatable Bonds
5
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 2641114-72-7 | (S)-Methyl 4-nitro-3-(((tetrahydrofuran-2-yl)methyl)amino)benzoate | 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: C₁₃H₁₆N₂O₅
Molecular Weight: 280.28
Synonyms: None
SMILES: O=C(OC)C1=CC=C([N+]([O-])=O)C(NC[C@H]2OCCC2)=C1
Tpsa: 90.7
Logp: 1.9723
H Acceptors: 6
H Donors: 1
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:
C₁₃H₁₆N₂O₅
Molecular Weight:
280.28
Synonyms:
None
SMILES:
O=C(OC)C1=CC=C([N+]([O-])=O)C(NC[C@H]2OCCC2)=C1
Tpsa:
90.7
Logp:
1.9723
H Acceptors:
6
H Donors:
1
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: C₂₂H₂₁FN₂O₆
Molecular Weight: 428.41
Synonyms: 3-Oxocitalopram oxalate
SMILES: N#CC1=CC=C2C(C(OC2(CCCN(C)C)C3=CC=C(C=C3)F)=O)=C1.O=C(C(O)=O)O
Tpsa: 127.93
Logp: 2.60878
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:
C₂₂H₂₁FN₂O₆
Molecular Weight:
428.41
Synonyms:
3-Oxocitalopram oxalate
SMILES:
N#CC1=CC=C2C(C(OC2(CCCN(C)C)C3=CC=C(C=C3)F)=O)=C1.O=C(C(O)=O)O
Tpsa:
127.93
Logp:
2.60878
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
5
Purity: 97%
MDL No: MFCD29079065
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₅NO₃
Molecular Weight: 269.30
Synonyms: Ketorolac methyl ester
SMILES: O=C(C1C2=CC=C(N2CC1)C(C3=CC=CC=C3)=O)OC
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
97%
MDL No:
MFCD29079065
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₅NO₃
Molecular Weight:
269.30
Synonyms:
Ketorolac methyl ester
SMILES:
O=C(C1C2=CC=C(N2CC1)C(C3=CC=CC=C3)=O)OC
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₆H₃₅FO₆
Molecular Weight: 462.55
Synonyms: Betamethasone Valerate EP Impurity I
SMILES: CCCCC(O[C@]1([C@@]2([C@@]([C@@]3([H])[C@]([C@H](C2)O)([C@@]4(C(CC3)=CC(C=C4)=O)C)F)([H])CC1)C)C(CO)=O)=O
Tpsa: 100.9
Logp: 3.3908
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₆H₃₅FO₆
Molecular Weight:
462.55
Synonyms:
Betamethasone Valerate EP Impurity I
SMILES:
CCCCC(O[C@]1([C@@]2([C@@]([C@@]3([H])[C@]([C@H](C2)O)([C@@]4(C(CC3)=CC(C=C4)=O)C)F)([H])CC1)C)C(CO)=O)=O
Tpsa:
100.9
Logp:
3.3908
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
6