CS-0531392
5-Methoxy-4-oxo-4H-chromene-3-carboxylic acid
Manufacturer: ChemScene
CAS Number: 76743-83-4
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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
C₁₁H₈O₅
Molecular Weight
220.18
Synonyms
None
SMILES
O=C(C1=COC2=CC=CC(OC)=C2C1=O)O
Tpsa
76.74
Logp
1.4998
H Acceptors
4
H Donors
1
Rotatable Bonds
2
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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: C₁₁H₈O₅
Molecular Weight: 220.18
Synonyms: None
SMILES: O=C(C1=COC2=CC=CC(OC)=C2C1=O)O
Tpsa: 76.74
Logp: 1.4998
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:
C₁₁H₈O₅
Molecular Weight:
220.18
Synonyms:
None
SMILES:
O=C(C1=COC2=CC=CC(OC)=C2C1=O)O
Tpsa:
76.74
Logp:
1.4998
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₂₂O
Molecular Weight: 242.36
Synonyms: 1-(2-Methoxyphenyl)tricyclo(3.3.1.13,7)decane
SMILES: COC1=C(C23CC4CC(C3)CC(C2)C4)C=CC=C1
Tpsa: 9.23
Logp: 4.163
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₂₂O
Molecular Weight:
242.36
Synonyms:
1-(2-Methoxyphenyl)tricyclo(3.3.1.13,7)decane
SMILES:
COC1=C(C23CC4CC(C3)CC(C2)C4)C=CC=C1
Tpsa:
9.23
Logp:
4.163
H Acceptors:
1
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: C₂₁H₂₁NO₅
Molecular Weight: 367.40
Synonyms: None
SMILES: OC([C@@H](CC1)O[C@@H]1CNC(OCC2C3=CC=CC=C3C4=CC=CC=C42)=O)=O
Tpsa: 84.86
Logp: 3.1573
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₂₁NO₅
Molecular Weight:
367.40
Synonyms:
None
SMILES:
OC([C@@H](CC1)O[C@@H]1CNC(OCC2C3=CC=CC=C3C4=CC=CC=C42)=O)=O
Tpsa:
84.86
Logp:
3.1573
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₂₃NO
Molecular Weight: 293.40
Synonyms: Amitriptyline Impurity 6
SMILES: OC1C2=C(/C(C3=C(C1)C=CC=C3)=C/CCN(C)C)C=CC=C2
Tpsa: 23.47
Logp: 3.6595
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:
C₂₀H₂₃NO
Molecular Weight:
293.40
Synonyms:
Amitriptyline Impurity 6
SMILES:
OC1C2=C(/C(C3=C(C1)C=CC=C3)=C/CCN(C)C)C=CC=C2
Tpsa:
23.47
Logp:
3.6595
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
3