CS-0746892
7-Hydroxy-5-methoxy-4-methyl-3-(4-methylpiperazin-1-yl)chromen-2-one;2-hydroxypropane-1,2,3-tricarboxylic acid
Manufacturer: ChemScene
CAS Number: 1523606-97-4
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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
C₂₂H₂₈N₂O₁₁
Molecular Weight
496.46
Synonyms
None
SMILES
OC(=O)CC(O)(CC(O)=O)C(O)=O.COC1=C2C(C)=C(N3CCN(C)CC3)C(=O)OC2=CC(O)=C1
Tpsa
198.28
Logp
0.31892
H Acceptors
10
H Donors
5
Rotatable Bonds
7
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: C₂₂H₂₈N₂O₁₁
Molecular Weight: 496.46
Synonyms: None
SMILES: OC(=O)CC(O)(CC(O)=O)C(O)=O.COC1=C2C(C)=C(N3CCN(C)CC3)C(=O)OC2=CC(O)=C1
Tpsa: 198.28
Logp: 0.31892
H Acceptors: 10
H Donors: 5
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₂₈N₂O₁₁
Molecular Weight:
496.46
Synonyms:
None
SMILES:
OC(=O)CC(O)(CC(O)=O)C(O)=O.COC1=C2C(C)=C(N3CCN(C)CC3)C(=O)OC2=CC(O)=C1
Tpsa:
198.28
Logp:
0.31892
H Acceptors:
10
H Donors:
5
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₂₁NO₉
Molecular Weight: 347.32
Synonyms: None
SMILES: O[C@H]([C@@H](O)C(O)=O)C(O)=O.COC(=O)[C@@H]1[C@H]2CC[C@@H](CC1=O)N2C
Tpsa: 161.67
Logp: -1.9114
H Acceptors: 8
H Donors: 4
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:
C₁₄H₂₁NO₉
Molecular Weight:
347.32
Synonyms:
None
SMILES:
O[C@H]([C@@H](O)C(O)=O)C(O)=O.COC(=O)[C@@H]1[C@H]2CC[C@@H](CC1=O)N2C
Tpsa:
161.67
Logp:
-1.9114
H Acceptors:
8
H Donors:
4
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: C₉H₆F₄O₃
Molecular Weight: 238.14
Synonyms: None
SMILES: COC(=O)C1=C(OC(F)(F)F)C=C(F)C=C1
Tpsa: 35.53
Logp: 2.5109
H Acceptors: 3
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:
C₉H₆F₄O₃
Molecular Weight:
238.14
Synonyms:
None
SMILES:
COC(=O)C1=C(OC(F)(F)F)C=C(F)C=C1
Tpsa:
35.53
Logp:
2.5109
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
2
Purity: 98%
MDL No: MFCD28795153
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₁NO₄
Molecular Weight: 209.20
Synonyms: None
SMILES: COC(=O)C1=CC(C)=CC(=C1C)[N+]([O-])=O
Tpsa: 69.44
Logp: 1.99824
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD28795153
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₁NO₄
Molecular Weight:
209.20
Synonyms:
None
SMILES:
COC(=O)C1=CC(C)=CC(=C1C)[N+]([O-])=O
Tpsa:
69.44
Logp:
1.99824
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2