CS-0882324
5-(3-Hydroxy-3-methylbut-1-yn-1-yl)-2-methoxybenzoic acid
Manufacturer: ChemScene
CAS Number: 2507401-12-7
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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
C₁₃H₁₄O₄
Molecular Weight
234.25
Synonyms
None
SMILES
O=C(O)C1=CC(C#CC(C)(O)C)=CC=C1OC
Tpsa
66.76
Logp
1.5158
H Acceptors
3
H Donors
2
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: C₁₃H₁₄O₄
Molecular Weight: 234.25
Synonyms: None
SMILES: O=C(O)C1=CC(C#CC(C)(O)C)=CC=C1OC
Tpsa: 66.76
Logp: 1.5158
H Acceptors: 3
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:
C₁₃H₁₄O₄
Molecular Weight:
234.25
Synonyms:
None
SMILES:
O=C(O)C1=CC(C#CC(C)(O)C)=CC=C1OC
Tpsa:
66.76
Logp:
1.5158
H Acceptors:
3
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: C₁₄H₂₀BBrO₂
Molecular Weight: 311.02
Synonyms: None
SMILES: CC1(C)C(C)(C)OB(C2=CC=C(Br)C(CC)=C2)O1
Tpsa: 18.46
Logp: 3.3107
H Acceptors: 2
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:
C₁₄H₂₀BBrO₂
Molecular Weight:
311.02
Synonyms:
None
SMILES:
CC1(C)C(C)(C)OB(C2=CC=C(Br)C(CC)=C2)O1
Tpsa:
18.46
Logp:
3.3107
H Acceptors:
2
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: C₉H₁₁NO₄
Molecular Weight: 197.19
Synonyms: None
SMILES: O=C(C1=C(OCC)C=CNC1=O)OC
Tpsa: 68.39
Logp: 0.5602
H Acceptors: 4
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:
C₉H₁₁NO₄
Molecular Weight:
197.19
Synonyms:
None
SMILES:
O=C(C1=C(OCC)C=CNC1=O)OC
Tpsa:
68.39
Logp:
0.5602
H Acceptors:
4
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: C₉H₆BrClN₂O
Molecular Weight: 273.51
Synonyms: None
SMILES: COC1=CC2=NC=CC(Cl)=C2N=C1Br
Tpsa: 35.01
Logp: 3.0543
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:
C₉H₆BrClN₂O
Molecular Weight:
273.51
Synonyms:
None
SMILES:
COC1=CC2=NC=CC(Cl)=C2N=C1Br
Tpsa:
35.01
Logp:
3.0543
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1