CS-1074588
(E)-4-(1-Methyl-1H-indol-3-yl)-2-oxobut-3-enoic acid
Manufacturer: ChemScene
CAS Number: 2648641-32-9
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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
C₁₃H₁₁NO₃
Molecular Weight
229.23
Synonyms
None
SMILES
C(=C/C(C(O)=O)=O)\C=1C=2C(N(C)C1)=CC=CC2
Tpsa
59.3
Logp
1.8452
H Acceptors
3
H Donors
1
Rotatable Bonds
3
Related Products
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: C₁₃H₁₁NO₃
Molecular Weight: 229.23
Synonyms: None
SMILES: C(=C/C(C(O)=O)=O)\C=1C=2C(N(C)C1)=CC=CC2
Tpsa: 59.3
Logp: 1.8452
H Acceptors: 3
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:
C₁₃H₁₁NO₃
Molecular Weight:
229.23
Synonyms:
None
SMILES:
C(=C/C(C(O)=O)=O)\C=1C=2C(N(C)C1)=CC=CC2
Tpsa:
59.3
Logp:
1.8452
H Acceptors:
3
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: C₁₀H₁₁NO₂
Molecular Weight: 177.20
Synonyms: None
SMILES: O=C(OC)C1=CN=C(C=C1C=C)C
Tpsa: 39.19
Logp: 1.81962
H Acceptors: 3
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:
C₁₀H₁₁NO₂
Molecular Weight:
177.20
Synonyms:
None
SMILES:
O=C(OC)C1=CN=C(C=C1C=C)C
Tpsa:
39.19
Logp:
1.81962
H Acceptors:
3
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: C₁₄H₁₇BCl₂N₂O₂
Molecular Weight: 327.01
Synonyms: None
SMILES: ClC1=NN(C=2C=CC(B3OC(C)(C)C(O3)(C)C)=C(Cl)C12)C
Tpsa: 36.28
Logp: 3.1793
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₇BCl₂N₂O₂
Molecular Weight:
327.01
Synonyms:
None
SMILES:
ClC1=NN(C=2C=CC(B3OC(C)(C)C(O3)(C)C)=C(Cl)C12)C
Tpsa:
36.28
Logp:
3.1793
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₅BrCl₂N₂
Molecular Weight: 279.95
Synonyms: None
SMILES: ClC1=NN(C=2C=CC(Br)=C(Cl)C12)C
Tpsa: 17.82
Logp: 3.6426
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:
C₈H₅BrCl₂N₂
Molecular Weight:
279.95
Synonyms:
None
SMILES:
ClC1=NN(C=2C=CC(Br)=C(Cl)C12)C
Tpsa:
17.82
Logp:
3.6426
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
0