CS-1139896
4-Ethynyl-4-hydroxy-2-methylcyclohexa-2,5-dien-1-one
Manufacturer: ChemScene
CAS Number: 108015-76-5
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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
C₉H₈O₂
Molecular Weight
148.16
Synonyms
None
SMILES
O=C1C=CC(O)(C#C)C=C1C
Tpsa
37.3
Logp
0.4359
H Acceptors
2
H Donors
1
Rotatable Bonds
0
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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: C₉H₈O₂
Molecular Weight: 148.16
Synonyms: None
SMILES: O=C1C=CC(O)(C#C)C=C1C
Tpsa: 37.3
Logp: 0.4359
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₈O₂
Molecular Weight:
148.16
Synonyms:
None
SMILES:
O=C1C=CC(O)(C#C)C=C1C
Tpsa:
37.3
Logp:
0.4359
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₀N₂O
Molecular Weight: 162.19
Synonyms: None
SMILES: O=C1NC2=CC=CC(=C2N1)CC
Tpsa: 48.65
Logp: 1.4186
H Acceptors: 1
H Donors: 2
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:
C₉H₁₀N₂O
Molecular Weight:
162.19
Synonyms:
None
SMILES:
O=C1NC2=CC=CC(=C2N1)CC
Tpsa:
48.65
Logp:
1.4186
H Acceptors:
1
H Donors:
2
Rotatable Bonds:
1
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₁NO₄
Molecular Weight: 245.23
Synonyms: None
SMILES: O=C(OCC)C1=CC=2C=CC=CC2C=C1N(=O)=O
Tpsa: 69.44
Logp: 2.9247
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₁NO₄
Molecular Weight:
245.23
Synonyms:
None
SMILES:
O=C(OCC)C1=CC=2C=CC=CC2C=C1N(=O)=O
Tpsa:
69.44
Logp:
2.9247
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
3
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₇ClO₃
Molecular Weight: 210.61
Synonyms: None
SMILES: O=C(O)C1C2=CC=C(Cl)C=C2C(=O)C1
Tpsa: 54.37
Logp: 2.0946
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₇ClO₃
Molecular Weight:
210.61
Synonyms:
None
SMILES:
O=C(O)C1C2=CC=C(Cl)C=C2C(=O)C1
Tpsa:
54.37
Logp:
2.0946
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1