CS-1074123
3-Methyl-5-oxocyclohexane-1-carboxylic acid
Manufacturer: ChemScene
CAS Number: 26448-97-5
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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
C₈H₁₂O₃
Molecular Weight
156.18
Synonyms
None
SMILES
O=C(O)C1CC(=O)CC(C)C1
Tpsa
54.37
Logp
1.0763
H Acceptors
2
H Donors
1
Rotatable Bonds
1
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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: C₈H₁₂O₃
Molecular Weight: 156.18
Synonyms: None
SMILES: O=C(O)C1CC(=O)CC(C)C1
Tpsa: 54.37
Logp: 1.0763
H Acceptors: 2
H Donors: 1
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:
C₈H₁₂O₃
Molecular Weight:
156.18
Synonyms:
None
SMILES:
O=C(O)C1CC(=O)CC(C)C1
Tpsa:
54.37
Logp:
1.0763
H Acceptors:
2
H Donors:
1
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: C₁₆H₁₈N₄O₃
Molecular Weight: 314.34
Synonyms: None
SMILES: OC1=CN2N=CN=C(NCC3=CC=C(OC)C=C3OC)C2=C1C
Tpsa: 80.91
Logp: 2.37262
H Acceptors: 7
H Donors: 2
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₈N₄O₃
Molecular Weight:
314.34
Synonyms:
None
SMILES:
OC1=CN2N=CN=C(NCC3=CC=C(OC)C=C3OC)C2=C1C
Tpsa:
80.91
Logp:
2.37262
H Acceptors:
7
H Donors:
2
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₆FNO₂
Molecular Weight: 167.14
Synonyms: None
SMILES: O=CC1=NC=2OCCC2C=C1F
Tpsa: 39.19
Logp: 0.9681
H Acceptors: 3
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:
C₈H₆FNO₂
Molecular Weight:
167.14
Synonyms:
None
SMILES:
O=CC1=NC=2OCCC2C=C1F
Tpsa:
39.19
Logp:
0.9681
H Acceptors:
3
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: C₉H₇FN₂S
Molecular Weight: 194.23
Synonyms: None
SMILES: FC1=CC=2SC(=NC2N=C1C=C)C
Tpsa: 25.78
Logp: 2.78182
H Acceptors: 3
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:
C₉H₇FN₂S
Molecular Weight:
194.23
Synonyms:
None
SMILES:
FC1=CC=2SC(=NC2N=C1C=C)C
Tpsa:
25.78
Logp:
2.78182
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1