CS-0652809
2-(tert-Butyl) 1-methyl (1S,3aR,4S,7S,7aR)-6-oxooctahydro-2H-4,7-methanoisoindole-1,2-dicarboxylate
Manufacturer: ChemScene
CAS Number: 2892292-28-1
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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
C₁₆H₂₃NO₅
Molecular Weight
309.36
Synonyms
None
SMILES
O=C([C@H]1N(C(OC(C)(C)C)=O)C[C@]2([H])[C@](C3)([H])CC([C@]3([H])[C@]12[H])=O)OC
Tpsa
72.91
Logp
1.62
H Acceptors
5
H Donors
0
Rotatable Bonds
1
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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: C₁₆H₂₃NO₅
Molecular Weight: 309.36
Synonyms: None
SMILES: O=C([C@H]1N(C(OC(C)(C)C)=O)C[C@]2([H])[C@](C3)([H])CC([C@]3([H])[C@]12[H])=O)OC
Tpsa: 72.91
Logp: 1.62
H Acceptors: 5
H Donors: 0
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:
C₁₆H₂₃NO₅
Molecular Weight:
309.36
Synonyms:
None
SMILES:
O=C([C@H]1N(C(OC(C)(C)C)=O)C[C@]2([H])[C@](C3)([H])CC([C@]3([H])[C@]12[H])=O)OC
Tpsa:
72.91
Logp:
1.62
H Acceptors:
5
H Donors:
0
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: C₈H₈FN₃
Molecular Weight: 165.17
Synonyms: None
SMILES: NC1=C(F)C=C2C(N=CN2C)=C1
Tpsa: 43.84
Logp: 1.2946
H Acceptors: 3
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:
C₈H₈FN₃
Molecular Weight:
165.17
Synonyms:
None
SMILES:
NC1=C(F)C=C2C(N=CN2C)=C1
Tpsa:
43.84
Logp:
1.2946
H Acceptors:
3
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: C₇H₉ClN₄
Molecular Weight: 184.63
Synonyms: None
SMILES: NC1=CC=C2C(N=CN2C)=N1.[H]Cl
Tpsa: 56.73
Logp: 0.9723
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:
C₇H₉ClN₄
Molecular Weight:
184.63
Synonyms:
None
SMILES:
NC1=CC=C2C(N=CN2C)=N1.[H]Cl
Tpsa:
56.73
Logp:
0.9723
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: C₈H₁₀F₂N₂
Molecular Weight: 172.18
Synonyms: None
SMILES: FC1(F)CC(CC2=CNN=C2)C1
Tpsa: 28.68
Logp: 1.9975
H Acceptors: 1
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:
C₈H₁₀F₂N₂
Molecular Weight:
172.18
Synonyms:
None
SMILES:
FC1(F)CC(CC2=CNN=C2)C1
Tpsa:
28.68
Logp:
1.9975
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
2