CS-1075496
4-(((Allyloxy)carbonyl)amino)-1-benzyl-1H-pyrrole-2-carboxylic acid
Manufacturer: ChemScene
CAS Number: 2680698-97-7
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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
C₁₆H₁₆N₂O₄
Molecular Weight
300.31
Synonyms
None
SMILES
O=C(O)C1=CC(=CN1CC=2C=CC=CC2)NC(=O)OCC=C
Tpsa
80.56
Logp
2.9691
H Acceptors
4
H Donors
2
Rotatable Bonds
6
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: C₁₆H₁₆N₂O₄
Molecular Weight: 300.31
Synonyms: None
SMILES: O=C(O)C1=CC(=CN1CC=2C=CC=CC2)NC(=O)OCC=C
Tpsa: 80.56
Logp: 2.9691
H Acceptors: 4
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:
C₁₆H₁₆N₂O₄
Molecular Weight:
300.31
Synonyms:
None
SMILES:
O=C(O)C1=CC(=CN1CC=2C=CC=CC2)NC(=O)OCC=C
Tpsa:
80.56
Logp:
2.9691
H Acceptors:
4
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: C₁₄H₁₇N₃O₂
Molecular Weight: 259.30
Synonyms: None
SMILES: N#CC1(N(C)C)CN(C(=O)OCC=2C=CC=CC2)C1
Tpsa: 56.57
Logp: 1.46278
H Acceptors: 4
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:
C₁₄H₁₇N₃O₂
Molecular Weight:
259.30
Synonyms:
None
SMILES:
N#CC1(N(C)C)CN(C(=O)OCC=2C=CC=CC2)C1
Tpsa:
56.57
Logp:
1.46278
H Acceptors:
4
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: C₁₃H₁₆FNO₃
Molecular Weight: 253.27
Synonyms: None
SMILES: O=C(OCC=1C=CC=CC1)N2CC(OC)(CF)C2
Tpsa: 38.77
Logp: 1.9935
H Acceptors: 3
H Donors: 0
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:
C₁₃H₁₆FNO₃
Molecular Weight:
253.27
Synonyms:
None
SMILES:
O=C(OCC=1C=CC=CC1)N2CC(OC)(CF)C2
Tpsa:
38.77
Logp:
1.9935
H Acceptors:
3
H Donors:
0
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: C₁₂H₁₄N₄O₄
Molecular Weight: 278.26
Synonyms: None
SMILES: O=C(O)C1=CC=C2C(=NC=NN12)NC(=O)OC(C)(C)C
Tpsa: 105.82
Logp: 1.7745
H Acceptors: 6
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:
C₁₂H₁₄N₄O₄
Molecular Weight:
278.26
Synonyms:
None
SMILES:
O=C(O)C1=CC=C2C(=NC=NN12)NC(=O)OC(C)(C)C
Tpsa:
105.82
Logp:
1.7745
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
2