CS-0137448
(S)-1-Isopropyl-3-oxocyclopentane-1-carboxylic acid
Manufacturer: ChemScene
CAS Number: 782493-13-4
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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
C₉H₁₄O₃
Molecular Weight
170.21
Synonyms
(1S)-3-Oxo-1-(propan-2-yl)cyclopentane-1-carboxylic acid
SMILES
O=C([C@]1(C(C)C)CC(CC1)=O)O
Tpsa
54.37
Logp
1.4664
H Acceptors
2
H Donors
1
Rotatable Bonds
2
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: C₉H₁₄O₃
Molecular Weight: 170.21
Synonyms: (1S)-3-Oxo-1-(propan-2-yl)cyclopentane-1-carboxylic acid
SMILES: O=C([C@]1(C(C)C)CC(CC1)=O)O
Tpsa: 54.37
Logp: 1.4664
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:
C₉H₁₄O₃
Molecular Weight:
170.21
Synonyms:
(1S)-3-Oxo-1-(propan-2-yl)cyclopentane-1-carboxylic acid
SMILES:
O=C([C@]1(C(C)C)CC(CC1)=O)O
Tpsa:
54.37
Logp:
1.4664
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: C₁₀H₁₆BNO₂
Molecular Weight: 193.05
Synonyms: None
SMILES: N#C[C@H]1[C@H](B2OC(C)(C)C(C)(C)O2)C1
Tpsa: 42.25
Logp: 1.99228
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:
C₁₀H₁₆BNO₂
Molecular Weight:
193.05
Synonyms:
None
SMILES:
N#C[C@H]1[C@H](B2OC(C)(C)C(C)(C)O2)C1
Tpsa:
42.25
Logp:
1.99228
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: C₆H₈F₃N₃O₂S
Molecular Weight: 243.21
Synonyms: 1H-Pyrazole-1-sulfonamide, N,N-dimethyl-3-(trifluoromethyl)
SMILES: O=S(N1N=C(C(F)(F)F)C=C1)(N(C)C)=O
Tpsa: 55.2
Logp: 0.5564
H Acceptors: 4
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:
C₆H₈F₃N₃O₂S
Molecular Weight:
243.21
Synonyms:
1H-Pyrazole-1-sulfonamide, N,N-dimethyl-3-(trifluoromethyl)
SMILES:
O=S(N1N=C(C(F)(F)F)C=C1)(N(C)C)=O
Tpsa:
55.2
Logp:
0.5564
H Acceptors:
4
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: C₁₅H₁₅N₃O₄
Molecular Weight: 301.30
Synonyms: Pyrrolo[3,4-c]pyrazole-3-carboxylic acid, 1,3a,4,5,6,6a-hexahydro-4,6-dioxo-5-(phenylmethyl)-, ethyl ester
SMILES: O=C(C1=NNC2C1C(N(CC3=CC=CC=C3)C2=O)=O)OCC
Tpsa: 88.07
Logp: 0.0625
H Acceptors: 6
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:
C₁₅H₁₅N₃O₄
Molecular Weight:
301.30
Synonyms:
Pyrrolo[3,4-c]pyrazole-3-carboxylic acid, 1,3a,4,5,6,6a-hexahydro-4,6-dioxo-5-(phenylmethyl)-, ethyl ester
SMILES:
O=C(C1=NNC2C1C(N(CC3=CC=CC=C3)C2=O)=O)OCC
Tpsa:
88.07
Logp:
0.0625
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
4