CS-0169479
6-Ethyl-1-oxo-2,3-dihydro-1H-indene-4-carboxylic acid
Manufacturer: ChemScene
CAS Number: 351011-79-5
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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
C₁₂H₁₂O₃
Molecular Weight
204.22
Synonyms
None
SMILES
CCC1=CC(C(CC2)=O)=C2C(C(O)=O)=C1
Tpsa
54.37
Logp
2.0761
H Acceptors
2
H Donors
1
Rotatable Bonds
2
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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: CCC1=CC(C(CC2)=O)=C2C(C(O)=O)=C1
Tpsa: 54.37
Logp: 2.0761
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:
C₁₂H₁₂O₃
Molecular Weight:
204.22
Synonyms:
None
SMILES:
CCC1=CC(C(CC2)=O)=C2C(C(O)=O)=C1
Tpsa:
54.37
Logp:
2.0761
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: C₉H₁₅NO₃
Molecular Weight: 185.22
Synonyms: None
SMILES: O=C(O)C(CCN1CCOCC1)=C
Tpsa: 49.77
Logp: 0.3495
H Acceptors: 3
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:
C₉H₁₅NO₃
Molecular Weight:
185.22
Synonyms:
None
SMILES:
O=C(O)C(CCN1CCOCC1)=C
Tpsa:
49.77
Logp:
0.3495
H Acceptors:
3
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: C₈H₁₂N₂O₂
Molecular Weight: 168.19
Synonyms: 1H-Pyrazole-3-carboxylic acid, 4-(1-methylethyl)-, methyl ester
SMILES: O=C(C1=NNC=C1C(C)C)OC
Tpsa: 54.98
Logp: 1.3197
H Acceptors: 3
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:
C₈H₁₂N₂O₂
Molecular Weight:
168.19
Synonyms:
1H-Pyrazole-3-carboxylic acid, 4-(1-methylethyl)-, methyl ester
SMILES:
O=C(C1=NNC=C1C(C)C)OC
Tpsa:
54.98
Logp:
1.3197
H Acceptors:
3
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: C₁₈H₂₁N₃O₂
Molecular Weight: 311.38
Synonyms: None
SMILES: N[C@@H](CCC(N)=O)C(NC(C1=CC=CC=C1)C2=CC=CC=C2)=O
Tpsa: 98.21
Logp: 1.485
H Acceptors: 3
H Donors: 3
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:
C₁₈H₂₁N₃O₂
Molecular Weight:
311.38
Synonyms:
None
SMILES:
N[C@@H](CCC(N)=O)C(NC(C1=CC=CC=C1)C2=CC=CC=C2)=O
Tpsa:
98.21
Logp:
1.485
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
7