CS-0801045
(1S,5R)-3,3-Difluoro-5-methylcyclohexane-1-carboxylic acid
Manufacturer: ChemScene
CAS Number: 2199500-16-6
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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
C₈H₁₂F₂O₂
Molecular Weight
178.18
Synonyms
None
SMILES
OC(=O)[C@@H]1CC(F)(F)C[C@H](C)C1
Tpsa
37.3
Logp
2.1425
H Acceptors
1
H Donors
1
Rotatable Bonds
1
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: C₈H₁₂F₂O₂
Molecular Weight: 178.18
Synonyms: None
SMILES: OC(=O)[C@@H]1CC(F)(F)C[C@H](C)C1
Tpsa: 37.3
Logp: 2.1425
H Acceptors: 1
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:
C₈H₁₂F₂O₂
Molecular Weight:
178.18
Synonyms:
None
SMILES:
OC(=O)[C@@H]1CC(F)(F)C[C@H](C)C1
Tpsa:
37.3
Logp:
2.1425
H Acceptors:
1
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: C₈H₁₀F₂O₂
Molecular Weight: 176.16
Synonyms: None
SMILES: COC(=O)[C@@H]1C[C@]2([H])[C@@](C1)([H])C2(F)F
Tpsa: 26.3
Logp: 1.4507
H Acceptors: 2
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:
C₈H₁₀F₂O₂
Molecular Weight:
176.16
Synonyms:
None
SMILES:
COC(=O)[C@@H]1C[C@]2([H])[C@@](C1)([H])C2(F)F
Tpsa:
26.3
Logp:
1.4507
H Acceptors:
2
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: C₁₀H₁₈N₂O₃S
Molecular Weight: 246.33
Synonyms: None
SMILES: CC(C)[C@H]1[C@@]2([H])[C@](CCN2)([H])N(S(=O)(C)=O)C1=O
Tpsa: 66.48
Logp: -0.2091
H Acceptors: 4
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:
C₁₀H₁₈N₂O₃S
Molecular Weight:
246.33
Synonyms:
None
SMILES:
CC(C)[C@H]1[C@@]2([H])[C@](CCN2)([H])N(S(=O)(C)=O)C1=O
Tpsa:
66.48
Logp:
-0.2091
H Acceptors:
4
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: C₁₇H₂₂N₂O₃
Molecular Weight: 302.37
Synonyms: None
SMILES: C1=CC=C(C=C1)COC(=O)N2[C@]3([H])[C@](CC2)([H])NC(=O)[C@H]3C(C)C
Tpsa: 58.64
Logp: 2.1681
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:
C₁₇H₂₂N₂O₃
Molecular Weight:
302.37
Synonyms:
None
SMILES:
C1=CC=C(C=C1)COC(=O)N2[C@]3([H])[C@](CC2)([H])NC(=O)[C@H]3C(C)C
Tpsa:
58.64
Logp:
2.1681
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
3