CS-0908358
Methyl 1-methyl-4-oxo-1H,4H,5H,6H-pyrrolo[3,4-c]pyrazole-6-carboxylate
Manufacturer: ChemScene
CAS Number: 2103816-51-7
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Purity
95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₈H₉N₃O₃
Molecular Weight
195.18
Synonyms
None
SMILES
O=C(C(C1=C2C=NN1C)NC2=O)OC
Tpsa
73.22
Logp
-0.6224
H Acceptors
5
H Donors
1
Rotatable Bonds
1
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
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Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₉N₃O₃
Molecular Weight: 195.18
Synonyms: None
SMILES: O=C(C(C1=C2C=NN1C)NC2=O)OC
Tpsa: 73.22
Logp: -0.6224
H Acceptors: 5
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:
C₈H₉N₃O₃
Molecular Weight:
195.18
Synonyms:
None
SMILES:
O=C(C(C1=C2C=NN1C)NC2=O)OC
Tpsa:
73.22
Logp:
-0.6224
H Acceptors:
5
H Donors:
1
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: C₃₅H₂₅F₃NO₇PS
Molecular Weight: 691.61
Synonyms: None
SMILES: O=P1(NS(=O)(C(F)(F)F)=O)OC2=C(C3=C(C(C4=CC=C(OC)C=C4)=CC5=C3C=CC=C5)O1)C6=C(C=CC=C6)C=C2C7=CC=C(C=C7)OC
Tpsa: 100.16
Logp: 9.3297
H Acceptors: 7
H Donors: 1
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₅H₂₅F₃NO₇PS
Molecular Weight:
691.61
Synonyms:
None
SMILES:
O=P1(NS(=O)(C(F)(F)F)=O)OC2=C(C3=C(C(C4=CC=C(OC)C=C4)=CC5=C3C=CC=C5)O1)C6=C(C=CC=C6)C=C2C7=CC=C(C=C7)OC
Tpsa:
100.16
Logp:
9.3297
H Acceptors:
7
H Donors:
1
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₇H₂₉F₃NO₅PS
Molecular Weight: 687.66
Synonyms: None
SMILES: O=P1(NS(=O)(C(F)(F)F)=O)OC2=C(C3=CC(C)=CC(C)=C3)C=C4C=CC=CC4=C2C5=C(C(C6=CC(C)=CC(C)=C6)=CC7=C5C=CC=C7)O1
Tpsa: 81.7
Logp: 10.54618
H Acceptors: 5
H Donors: 1
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:
C₃₇H₂₉F₃NO₅PS
Molecular Weight:
687.66
Synonyms:
None
SMILES:
O=P1(NS(=O)(C(F)(F)F)=O)OC2=C(C3=CC(C)=CC(C)=C3)C=C4C=CC=CC4=C2C5=C(C(C6=CC(C)=CC(C)=C6)=CC7=C5C=CC=C7)O1
Tpsa:
81.7
Logp:
10.54618
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
4
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅₇H₃₇F₃NO₅PS
Molecular Weight: 935.94
Synonyms: None
SMILES: O=P1(NS(=O)(C(F)(F)F)=O)OC2=C(C3=C4C=CC=CC4=CC(C5=CC(C6=CC=CC=C6)=CC(C7=CC=CC=C7)=C5)=C3O1)C8=C(C=CC=C8)C=C2C9=CC(C%10=CC=CC=C%10)=CC(C%11=CC=CC=C%11)=C9
Tpsa: 81.7
Logp: 15.9805
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 8
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅₇H₃₇F₃NO₅PS
Molecular Weight:
935.94
Synonyms:
None
SMILES:
O=P1(NS(=O)(C(F)(F)F)=O)OC2=C(C3=C4C=CC=CC4=CC(C5=CC(C6=CC=CC=C6)=CC(C7=CC=CC=C7)=C5)=C3O1)C8=C(C=CC=C8)C=C2C9=CC(C%10=CC=CC=C%10)=CC(C%11=CC=CC=C%11)=C9
Tpsa:
81.7
Logp:
15.9805
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
8