CS-0585428
2-(Isoindolin-2-yl)butanoic acid
Manufacturer: ChemScene
CAS Number: 1247162-31-7
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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
C₁₂H₁₅NO₂
Molecular Weight
205.25
Synonyms
2-(2,3-dihydro-1h-isoindol-2-yl)butanoic acid
SMILES
CCC(C(=O)O)N1CC2=CC=CC=C2C1
Tpsa
40.54
Logp
1.8654
H Acceptors
2
H Donors
1
Rotatable Bonds
3
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: C₁₂H₁₅NO₂
Molecular Weight: 205.25
Synonyms: 2-(2,3-dihydro-1h-isoindol-2-yl)butanoic acid
SMILES: CCC(C(=O)O)N1CC2=CC=CC=C2C1
Tpsa: 40.54
Logp: 1.8654
H Acceptors: 2
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:
C₁₂H₁₅NO₂
Molecular Weight:
205.25
Synonyms:
2-(2,3-dihydro-1h-isoindol-2-yl)butanoic acid
SMILES:
CCC(C(=O)O)N1CC2=CC=CC=C2C1
Tpsa:
40.54
Logp:
1.8654
H Acceptors:
2
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: C₁₁H₁₇N₃O
Molecular Weight: 207.27
Synonyms: 4-[(6-methylpyrimidin-4-yl)amino]cyclohexan-1-ol
SMILES: OC1CCC(NC2=NC=NC(C)=C2)CC1
Tpsa: 58.04
Logp: 1.50042
H Acceptors: 4
H Donors: 2
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:
C₁₁H₁₇N₃O
Molecular Weight:
207.27
Synonyms:
4-[(6-methylpyrimidin-4-yl)amino]cyclohexan-1-ol
SMILES:
OC1CCC(NC2=NC=NC(C)=C2)CC1
Tpsa:
58.04
Logp:
1.50042
H Acceptors:
4
H Donors:
2
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: C₉H₁₀ClNO₄
Molecular Weight: 231.63
Synonyms: None
SMILES: O=C(O)C(NC(=O)C=1OC(Cl)=CC1)(C)C
Tpsa: 79.54
Logp: 1.526
H Acceptors: 3
H Donors: 2
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:
C₉H₁₀ClNO₄
Molecular Weight:
231.63
Synonyms:
None
SMILES:
O=C(O)C(NC(=O)C=1OC(Cl)=CC1)(C)C
Tpsa:
79.54
Logp:
1.526
H Acceptors:
3
H Donors:
2
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: C₉H₁₃N₃O₂S
Molecular Weight: 227.28
Synonyms: 1-(4-methyl-1,2,3-thiadiazole-5-carbonyl)pyrrolidin-3-yl]methanol
SMILES: CC1=C(SN=N1)C(=O)N2CCC(C2)CO
Tpsa: 66.32
Logp: 0.30092
H Acceptors: 5
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:
C₉H₁₃N₃O₂S
Molecular Weight:
227.28
Synonyms:
1-(4-methyl-1,2,3-thiadiazole-5-carbonyl)pyrrolidin-3-yl]methanol
SMILES:
CC1=C(SN=N1)C(=O)N2CCC(C2)CO
Tpsa:
66.32
Logp:
0.30092
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2