CS-0606807
(E)-4-(2,5-dimethylphenyl)-4-oxobut-2-enoic acid
Manufacturer: ChemScene
CAS Number: 159971-25-2
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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
C₁₂H₁₂O₃
Molecular Weight
204.22
Synonyms
None
SMILES
O=C(O)/C=C/C(C1=CC(C)=CC=C1C)=O
Tpsa
54.37
Logp
2.12694
H Acceptors
2
H Donors
1
Rotatable Bonds
3
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 159971-25-2 | (2E)-4-(2,5-Dimethylphenyl)-4-oxo-2-butenoic 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: C₁₂H₁₂O₃
Molecular Weight: 204.22
Synonyms: None
SMILES: O=C(O)/C=C/C(C1=CC(C)=CC=C1C)=O
Tpsa: 54.37
Logp: 2.12694
H Acceptors: 2
H Donors: 1
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:
C₁₂H₁₂O₃
Molecular Weight:
204.22
Synonyms:
None
SMILES:
O=C(O)/C=C/C(C1=CC(C)=CC=C1C)=O
Tpsa:
54.37
Logp:
2.12694
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: MFCD15146363
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₂₇NO₇S
Molecular Weight: 401.47
Synonyms: None
SMILES: CC(C)(C)OC(=O)[C@H](CCCOS(=O)(=O)C)NC(=O)OCC1=CC=CC=C1
Tpsa: 108
Logp: 2.3795
H Acceptors: 7
H Donors: 1
Rotatable Bonds: 9
Purity:
98%
MDL No:
MFCD15146363
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₂₇NO₇S
Molecular Weight:
401.47
Synonyms:
None
SMILES:
CC(C)(C)OC(=O)[C@H](CCCOS(=O)(=O)C)NC(=O)OCC1=CC=CC=C1
Tpsa:
108
Logp:
2.3795
H Acceptors:
7
H Donors:
1
Rotatable Bonds:
9
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₃N₃O₂S
Molecular Weight: 263.32
Synonyms: None
SMILES: C1=CC=C(C(=C1)N)S(=O)(=O)NCC2=CN=CC=C2
Tpsa: 85.08
Logp: 1.1423
H Acceptors: 4
H Donors: 2
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:
C₁₂H₁₃N₃O₂S
Molecular Weight:
263.32
Synonyms:
None
SMILES:
C1=CC=C(C(=C1)N)S(=O)(=O)NCC2=CN=CC=C2
Tpsa:
85.08
Logp:
1.1423
H Acceptors:
4
H Donors:
2
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: C₁₁H₁₀ClNO
Molecular Weight: 207.66
Synonyms: None
SMILES: COC1=C(C=C(C=C1)Cl)N2C=CC=C2
Tpsa: 14.16
Logp: 3.1393
H Acceptors: 2
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:
C₁₁H₁₀ClNO
Molecular Weight:
207.66
Synonyms:
None
SMILES:
COC1=C(C=C(C=C1)Cl)N2C=CC=C2
Tpsa:
14.16
Logp:
3.1393
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
2