CS-0255204
(E)-4-(3-(Benzo[d][1,3]dioxol-5-yl)-3-oxoprop-1-en-1-yl)benzoic acid
Manufacturer: ChemScene
CAS Number: 1014629-59-4
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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
C₁₇H₁₂O₅
Molecular Weight
296.27
Synonyms
4-(3-Benzo[1,3]dioxol-5-yl-3-oxo-propenyl)-benzoic acid
SMILES
O=C(O)C1=CC=C(/C=C/C(C2=CC=C(OCO3)C3=C2)=O)C=C1
Tpsa
72.83
Logp
3.0096
H Acceptors
4
H Donors
1
Rotatable Bonds
4
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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: C₁₇H₁₂O₅
Molecular Weight: 296.27
Synonyms: 4-(3-Benzo[1,3]dioxol-5-yl-3-oxo-propenyl)-benzoic acid
SMILES: O=C(O)C1=CC=C(/C=C/C(C2=CC=C(OCO3)C3=C2)=O)C=C1
Tpsa: 72.83
Logp: 3.0096
H Acceptors: 4
H Donors: 1
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:
C₁₇H₁₂O₅
Molecular Weight:
296.27
Synonyms:
4-(3-Benzo[1,3]dioxol-5-yl-3-oxo-propenyl)-benzoic acid
SMILES:
O=C(O)C1=CC=C(/C=C/C(C2=CC=C(OCO3)C3=C2)=O)C=C1
Tpsa:
72.83
Logp:
3.0096
H Acceptors:
4
H Donors:
1
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: C₁₉H₁₈O₆
Molecular Weight: 342.34
Synonyms: 4-[3-Oxo-3-(3,4,5-trimethoxy-phenyl)-propenyl]-benzoic acid
SMILES: O=C(O)C1=CC=C(/C=C/C(C2=CC(OC)=C(OC)C(OC)=C2)=O)C=C1
Tpsa: 82.06
Logp: 3.3067
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₁₈O₆
Molecular Weight:
342.34
Synonyms:
4-[3-Oxo-3-(3,4,5-trimethoxy-phenyl)-propenyl]-benzoic acid
SMILES:
O=C(O)C1=CC=C(/C=C/C(C2=CC(OC)=C(OC)C(OC)=C2)=O)C=C1
Tpsa:
82.06
Logp:
3.3067
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₄O₄
Molecular Weight: 282.29
Synonyms: None
SMILES: O=C(O)C1=CC=C(/C=C/C(C2=CC=CC=C2OC)=O)C=C1
Tpsa: 63.6
Logp: 3.2895
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:
C₁₇H₁₄O₄
Molecular Weight:
282.29
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(/C=C/C(C2=CC=CC=C2OC)=O)C=C1
Tpsa:
63.6
Logp:
3.2895
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: C₁₆H₁₁NO₅
Molecular Weight: 297.26
Synonyms: None
SMILES: O=C(O)C1=CC=C(/C=C/C(C2=CC=CC([N+]([O-])=O)=C2)=O)C=C1
Tpsa: 97.51
Logp: 3.1891
H Acceptors: 4
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:
C₁₆H₁₁NO₅
Molecular Weight:
297.26
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(/C=C/C(C2=CC=CC([N+]([O-])=O)=C2)=O)C=C1
Tpsa:
97.51
Logp:
3.1891
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
5