CS-0005752
(E)-3-(ethoxycarbonyl)-4-(4-fluorophenyl)but-3-enoic acid
Manufacturer: ChemScene
CAS Number: 153289-33-9
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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
C₁₃H₁₃FO₄
Molecular Weight
252.24
Synonyms
None
SMILES
O=C(OCC)/C(CC(O)=O)=C/C1=CC=C(F)C=C1
Tpsa
63.6
Logp
2.2469
H Acceptors
3
H Donors
1
Rotatable Bonds
5
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 153289-33-9 | (E)-3-(ethoxycarbonyl)-4-(4-fluorophenyl)but-3-enoic acid | 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: C₁₃H₁₃FO₄
Molecular Weight: 252.24
Synonyms: None
SMILES: O=C(OCC)/C(CC(O)=O)=C/C1=CC=C(F)C=C1
Tpsa: 63.6
Logp: 2.2469
H Acceptors: 3
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:
C₁₃H₁₃FO₄
Molecular Weight:
252.24
Synonyms:
None
SMILES:
O=C(OCC)/C(CC(O)=O)=C/C1=CC=C(F)C=C1
Tpsa:
63.6
Logp:
2.2469
H Acceptors:
3
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: C₁₃H₁₃NO₂
Molecular Weight: 215.25
Synonyms: None
SMILES: O=C(N)CC1=CCC2=C1C3=C(C=C2)OCC3
Tpsa: 52.32
Logp: 1.4364
H Acceptors: 2
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:
C₁₃H₁₃NO₂
Molecular Weight:
215.25
Synonyms:
None
SMILES:
O=C(N)CC1=CCC2=C1C3=C(C=C2)OCC3
Tpsa:
52.32
Logp:
1.4364
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₂O₂
Molecular Weight: 176.21
Synonyms: 2,6,7,8-tetrahydro-1H-cyclopenta[e][1]benzofuran-8-ol
SMILES: OC1C2=C3C(OCC3)=CC=C2CC1
Tpsa: 29.46
Logp: 1.6011
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 0
Purity:
97%
MDL No:
None
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₂O₂
Molecular Weight:
176.21
Synonyms:
2,6,7,8-tetrahydro-1H-cyclopenta[e][1]benzofuran-8-ol
SMILES:
OC1C2=C3C(OCC3)=CC=C2CC1
Tpsa:
29.46
Logp:
1.6011
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: MFCD00009130
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₆O₆
Molecular Weight: 220.22
Synonyms: Bis(hydroxymethyl)propanedioic acid diethyl ester; Diethyl 2,2-bis(hydroxymethyl)malonate; Diethyl bis(hydroxymethyl)malonate; Diethyl α,α-bis(hydroxymethyl)malonate; NSC 218327; Ethyl Dimethylol Malonate
SMILES: O=C(OCC)C(CO)(CO)C(OCC)=O
Tpsa: 93.06
Logp: -0.9164
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 6
Purity:
98%
MDL No:
MFCD00009130
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₆O₆
Molecular Weight:
220.22
Synonyms:
Bis(hydroxymethyl)propanedioic acid diethyl ester; Diethyl 2,2-bis(hydroxymethyl)malonate; Diethyl bis(hydroxymethyl)malonate; Diethyl α,α-bis(hydroxymethyl)malonate; NSC 218327; Ethyl Dimethylol Malonate
SMILES:
O=C(OCC)C(CO)(CO)C(OCC)=O
Tpsa:
93.06
Logp:
-0.9164
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
6