CS-0649940
8-Methoxy-3-methyl-9-nitro-3,4,5,6-tetrahydrobenzo[b]pyrazolo[4,3-d]azepine
Manufacturer: ChemScene
CAS Number: 2726464-96-4
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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
C₁₃H₁₄N₄O₃
Molecular Weight
274.28
Synonyms
None
SMILES
CN1C(CCNC2=C3C=C([N+]([O-])=O)C(OC)=C2)=C3C=N1
Tpsa
82.22
Logp
1.9719
H Acceptors
6
H Donors
1
Rotatable Bonds
2
Related Products
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: C₁₃H₁₄N₄O₃
Molecular Weight: 274.28
Synonyms: None
SMILES: CN1C(CCNC2=C3C=C([N+]([O-])=O)C(OC)=C2)=C3C=N1
Tpsa: 82.22
Logp: 1.9719
H Acceptors: 6
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:
C₁₃H₁₄N₄O₃
Molecular Weight:
274.28
Synonyms:
None
SMILES:
CN1C(CCNC2=C3C=C([N+]([O-])=O)C(OC)=C2)=C3C=N1
Tpsa:
82.22
Logp:
1.9719
H Acceptors:
6
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: C₁₃H₁₆N₄O
Molecular Weight: 244.29
Synonyms: None
SMILES: CN1C(CCNC2=C3C=C(N)C(OC)=C2)=C3C=N1
Tpsa: 65.1
Logp: 1.6459
H Acceptors: 5
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:
C₁₃H₁₆N₄O
Molecular Weight:
244.29
Synonyms:
None
SMILES:
CN1C(CCNC2=C3C=C(N)C(OC)=C2)=C3C=N1
Tpsa:
65.1
Logp:
1.6459
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₈H₄₆O₆
Molecular Weight: 478.66
Synonyms: None
SMILES: C[C@@]12[C@]3([H])[C@]([C@H](O)C[C@]1([H])C[C@@H](CC2)OC(OCC)=O)([H])[C@@]4([H])[C@](CC3)([C@@](CC4)([H])[C@H](C)CCC(OC)=O)C
Tpsa: 82.06
Logp: 5.7471
H Acceptors: 6
H Donors: 1
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₈H₄₆O₆
Molecular Weight:
478.66
Synonyms:
None
SMILES:
C[C@@]12[C@]3([H])[C@]([C@H](O)C[C@]1([H])C[C@@H](CC2)OC(OCC)=O)([H])[C@@]4([H])[C@](CC3)([C@@](CC4)([H])[C@H](C)CCC(OC)=O)C
Tpsa:
82.06
Logp:
5.7471
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
6
Purity: 97%
MDL No: None
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₂₄O₂Si
Molecular Weight: 228.40
Synonyms: None
SMILES: O=C1CCCCC1O[Si](C)(C(C)(C)C)C
Tpsa: 26.3
Logp: 3.5199
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 2
Purity:
97%
MDL No:
None
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₂₄O₂Si
Molecular Weight:
228.40
Synonyms:
None
SMILES:
O=C1CCCCC1O[Si](C)(C(C)(C)C)C
Tpsa:
26.3
Logp:
3.5199
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
2