CS-0014016
(E)-3-(4-cyano-2,6-dimethylphenyl)acrylic acid
Manufacturer: ChemScene
CAS Number: 2387484-77-5
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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
C₁₂H₁₁NO₂
Molecular Weight
201.22
Synonyms
None
SMILES
CC1=C(/C=C/C(O)=O)C(C)=CC(C#N)=C1
Tpsa
61.09
Logp
2.27292
H Acceptors
2
H Donors
1
Rotatable Bonds
2
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 2387484-77-5 | (E)-3-(4-cyano-2,6-dimethylphenyl)acrylic acid | A2B Chem | -- |
SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
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: C₁₂H₁₁NO₂
Molecular Weight: 201.22
Synonyms: None
SMILES: CC1=C(/C=C/C(O)=O)C(C)=CC(C#N)=C1
Tpsa: 61.09
Logp: 2.27292
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:
C₁₂H₁₁NO₂
Molecular Weight:
201.22
Synonyms:
None
SMILES:
CC1=C(/C=C/C(O)=O)C(C)=CC(C#N)=C1
Tpsa:
61.09
Logp:
2.27292
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2
Purity: 95%
MDL No: MFCD21359482
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₆BrClO₂
Molecular Weight: 261.50
Synonyms: 8-BROMO-5-CHLORO-3,4-DIHYDRO-2H-1-BENZOPYRAN-4-ONE
SMILES: O=C1CCOC2=C(Br)C=CC(Cl)=C12
Tpsa: 26.3
Logp: 3.0677
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 0
Purity:
95%
MDL No:
MFCD21359482
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₆BrClO₂
Molecular Weight:
261.50
Synonyms:
8-BROMO-5-CHLORO-3,4-DIHYDRO-2H-1-BENZOPYRAN-4-ONE
SMILES:
O=C1CCOC2=C(Br)C=CC(Cl)=C12
Tpsa:
26.3
Logp:
3.0677
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₉N₅O₆S₂
Molecular Weight: 453.49
Synonyms: Cefcapene; Cefcapene pivoxil free acid; S 1006; S 1006 (pharmaceutical); (6R,7R)-7-{[(2Z)-2-(2-Amino-1,3-thiazol-4-yl)pent-2-enoyl]amino}-3-[(carbamoyloxy)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SMILES: O=C(C(N12)=C(COC(N)=O)CS[C@]2([H])[C@H](NC(/C(C3=CSC(N)=N3)=C\CC)=O)C1=O)O
Tpsa: 177.94
Logp: 0.3526
H Acceptors: 9
H Donors: 4
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:
C₁₇H₁₉N₅O₆S₂
Molecular Weight:
453.49
Synonyms:
Cefcapene; Cefcapene pivoxil free acid; S 1006; S 1006 (pharmaceutical); (6R,7R)-7-{[(2Z)-2-(2-Amino-1,3-thiazol-4-yl)pent-2-enoyl]amino}-3-[(carbamoyloxy)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SMILES:
O=C(C(N12)=C(COC(N)=O)CS[C@]2([H])[C@H](NC(/C(C3=CSC(N)=N3)=C\CC)=O)C1=O)O
Tpsa:
177.94
Logp:
0.3526
H Acceptors:
9
H Donors:
4
Rotatable Bonds:
7
Purity: 97%
MDL No: MFCD00865787
Storage: -20°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₁H₂₈N₂O₅
Molecular Weight: 388.46
Synonyms: HOE 498 diacid; Ramipril diacid
SMILES: O=C([C@@H]1C[C@@](CCC2)([H])[C@@]2([H])N1C([C@@H](N[C@H](C(O)=O)CCC3=CC=CC=C3)C)=O)O
Tpsa: 106.94
Logp: 1.9047
H Acceptors: 4
H Donors: 3
Rotatable Bonds: 8
Purity:
97%
MDL No:
MFCD00865787
Storage:
-20°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₂₈N₂O₅
Molecular Weight:
388.46
Synonyms:
HOE 498 diacid; Ramipril diacid
SMILES:
O=C([C@@H]1C[C@@](CCC2)([H])[C@@]2([H])N1C([C@@H](N[C@H](C(O)=O)CCC3=CC=CC=C3)C)=O)O
Tpsa:
106.94
Logp:
1.9047
H Acceptors:
4
H Donors:
3
Rotatable Bonds:
8