CS-0102550
Neopatulin
Manufacturer: ChemScene
CAS Number: 70402-10-7
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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
C₇H₆O₄
Molecular Weight
154.12
Synonyms
None
SMILES
O=C1C=C2COC(O)C=C2O1
Tpsa
55.76
Logp
-0.2979
H Acceptors
4
H Donors
1
Rotatable Bonds
0
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: C₇H₆O₄
Molecular Weight: 154.12
Synonyms: None
SMILES: O=C1C=C2COC(O)C=C2O1
Tpsa: 55.76
Logp: -0.2979
H Acceptors: 4
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:
C₇H₆O₄
Molecular Weight:
154.12
Synonyms:
None
SMILES:
O=C1C=C2COC(O)C=C2O1
Tpsa:
55.76
Logp:
-0.2979
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: MFCD00136039
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₁₂NaO₉P
Molecular Weight: 282.12
Synonyms: None
SMILES: O=C[C@@H]([C@H]([C@@H]([C@@H](COP(O)(O)=O)O)O)O)[O-].[Na+]
Tpsa: 167.58
Logp: -6.8898
H Acceptors: 7
H Donors: 5
Rotatable Bonds: 7
Purity:
98%
MDL No:
MFCD00136039
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₁₂NaO₉P
Molecular Weight:
282.12
Synonyms:
None
SMILES:
O=C[C@@H]([C@H]([C@@H]([C@@H](COP(O)(O)=O)O)O)O)[O-].[Na+]
Tpsa:
167.58
Logp:
-6.8898
H Acceptors:
7
H Donors:
5
Rotatable Bonds:
7
Purity: 98%
MDL No: MFCD00082354
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄H₅NO₃
Molecular Weight: 115.09
Synonyms: None
SMILES: O=C(O)/C=C\C(N)=O
Tpsa: 80.39
Logp: -0.8875
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD00082354
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄H₅NO₃
Molecular Weight:
115.09
Synonyms:
None
SMILES:
O=C(O)/C=C\C(N)=O
Tpsa:
80.39
Logp:
-0.8875
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
2
Purity: 98%
MDL No: MFCD11847594
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₆ClNO
Molecular Weight: 179.60
Synonyms: 5-chloro-2H-isoquinolin-1-one
SMILES: O=C1NC=CC2=C1C=CC=C2Cl
Tpsa: 32.86
Logp: 2.1815
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
MFCD11847594
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₆ClNO
Molecular Weight:
179.60
Synonyms:
5-chloro-2H-isoquinolin-1-one
SMILES:
O=C1NC=CC2=C1C=CC=C2Cl
Tpsa:
32.86
Logp:
2.1815
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
0