CS-0330345
Methyl 3-nitro-4-(pyrrolidin-1-yl)benzoate
Manufacturer: ChemScene
CAS Number: 91567-80-5
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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
C₁₂H₁₄N₂O₄
Molecular Weight
250.25
Synonyms
None
SMILES
COC(=O)C1=CC=C(C(=C1)[N+](=O)[O-])N2CCCC2
Tpsa
72.68
Logp
1.9816
H Acceptors
5
H Donors
0
Rotatable Bonds
3
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 91567-80-5 | methyl 3-nitro-4-pyrrolidin-1-ylbenzoate | A2B Chem | -- |
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: C₁₂H₁₄N₂O₄
Molecular Weight: 250.25
Synonyms: None
SMILES: COC(=O)C1=CC=C(C(=C1)[N+](=O)[O-])N2CCCC2
Tpsa: 72.68
Logp: 1.9816
H Acceptors: 5
H Donors: 0
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:
C₁₂H₁₄N₂O₄
Molecular Weight:
250.25
Synonyms:
None
SMILES:
COC(=O)C1=CC=C(C(=C1)[N+](=O)[O-])N2CCCC2
Tpsa:
72.68
Logp:
1.9816
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
3
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₄N₂
Molecular Weight: 186.25
Synonyms: 2-Cyclopentyl-1H-1,3-benzodiazole
SMILES: C1(C2CCCC2)=NC3=CC=CC=C3N1
Tpsa: 28.68
Logp: 3.2205
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 1
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₄N₂
Molecular Weight:
186.25
Synonyms:
2-Cyclopentyl-1H-1,3-benzodiazole
SMILES:
C1(C2CCCC2)=NC3=CC=CC=C3N1
Tpsa:
28.68
Logp:
3.2205
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₁NO₃
Molecular Weight: 217.22
Synonyms: None
SMILES: COC(=O)CN1C=CC(=O)C2=CC=CC=C21
Tpsa: 48.3
Logp: 1.1745
H Acceptors: 4
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:
C₁₂H₁₁NO₃
Molecular Weight:
217.22
Synonyms:
None
SMILES:
COC(=O)CN1C=CC(=O)C2=CC=CC=C21
Tpsa:
48.3
Logp:
1.1745
H Acceptors:
4
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: C₁₀H₈F₃NO₄
Molecular Weight: 263.17
Synonyms: 4-methoxy-3-[(trifluoroacetyl)amino]benzoic acid
SMILES: COC1=C(NC(C(F)(F)F)=O)C=C(C(O)=O)C=C1
Tpsa: 75.63
Logp: 1.8942
H Acceptors: 3
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:
C₁₀H₈F₃NO₄
Molecular Weight:
263.17
Synonyms:
4-methoxy-3-[(trifluoroacetyl)amino]benzoic acid
SMILES:
COC1=C(NC(C(F)(F)F)=O)C=C(C(O)=O)C=C1
Tpsa:
75.63
Logp:
1.8942
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
3