CS-1140599
4-(6-Cyano-1H-indol-3-yl)-4-oxobutanoic acid
Manufacturer: ChemScene
CAS Number: 1986955-86-5
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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
C₁₃H₁₀N₂O₃
Molecular Weight
242.23
Synonyms
None
SMILES
N#CC=1C=CC2=C(C1)NC=C2C(=O)CCC(=O)O
Tpsa
93.95
Logp
2.08708
H Acceptors
3
H Donors
2
Rotatable Bonds
4
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: C₁₃H₁₀N₂O₃
Molecular Weight: 242.23
Synonyms: None
SMILES: N#CC=1C=CC2=C(C1)NC=C2C(=O)CCC(=O)O
Tpsa: 93.95
Logp: 2.08708
H Acceptors: 3
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:
C₁₃H₁₀N₂O₃
Molecular Weight:
242.23
Synonyms:
None
SMILES:
N#CC=1C=CC2=C(C1)NC=C2C(=O)CCC(=O)O
Tpsa:
93.95
Logp:
2.08708
H Acceptors:
3
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: C₉H₁₁BrF₂N₂O₂
Molecular Weight: 297.10
Synonyms: None
SMILES: O=C(O)CC(N1N=C(C(Br)=C1C)C(F)F)C
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₁BrF₂N₂O₂
Molecular Weight:
297.10
Synonyms:
None
SMILES:
O=C(O)CC(N1N=C(C(Br)=C1C)C(F)F)C
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₃BrN₂O
Molecular Weight: 269.14
Synonyms: None
SMILES: O=C(NC1CCCC1)C=2C=CN=CC2Br
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₃BrN₂O
Molecular Weight:
269.14
Synonyms:
None
SMILES:
O=C(NC1CCCC1)C=2C=CN=CC2Br
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₅ClF₂N₂O
Molecular Weight: 218.59
Synonyms: None
SMILES: N#CCC1=NC(Cl)=C(OC(F)F)C=C1
Tpsa: 45.91
Logp: 2.40248
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₅ClF₂N₂O
Molecular Weight:
218.59
Synonyms:
None
SMILES:
N#CCC1=NC(Cl)=C(OC(F)F)C=C1
Tpsa:
45.91
Logp:
2.40248
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3