CS-0644588
1-((4aR,7aR)-Octahydro-1H-pyrrolo[3,4-b]pyridin-1-yl)ethan-1-one
Manufacturer: ChemScene
CAS Number: 845626-20-2
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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
C₉H₁₆N₂O
Molecular Weight
168.24
Synonyms
None
SMILES
CC(N1CCC[C@@]2([H])[C@]1([H])CNC2)=O
Tpsa
32.34
Logp
0.2167
H Acceptors
2
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: C₉H₁₆N₂O
Molecular Weight: 168.24
Synonyms: None
SMILES: CC(N1CCC[C@@]2([H])[C@]1([H])CNC2)=O
Tpsa: 32.34
Logp: 0.2167
H Acceptors: 2
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:
C₉H₁₆N₂O
Molecular Weight:
168.24
Synonyms:
None
SMILES:
CC(N1CCC[C@@]2([H])[C@]1([H])CNC2)=O
Tpsa:
32.34
Logp:
0.2167
H Acceptors:
2
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: C₁₀H₁₁FO₃
Molecular Weight: 198.19
Synonyms: None
SMILES: O=C(OCC)CC1=CC(F)=CC=C1O
Tpsa: 46.53
Logp: 1.6369
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₁FO₃
Molecular Weight:
198.19
Synonyms:
None
SMILES:
O=C(OCC)CC1=CC(F)=CC=C1O
Tpsa:
46.53
Logp:
1.6369
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₇ClFNO
Molecular Weight: 175.59
Synonyms: None
SMILES: NC1=CC(OC)=C(Cl)C(F)=C1
Tpsa: 35.25
Logp: 2.0699
H Acceptors: 2
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:
C₇H₇ClFNO
Molecular Weight:
175.59
Synonyms:
None
SMILES:
NC1=CC(OC)=C(Cl)C(F)=C1
Tpsa:
35.25
Logp:
2.0699
H Acceptors:
2
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: C₆H₁₃NO₂
Molecular Weight: 131.17
Synonyms: None
SMILES: OC[C@H](N)C1COCC1
Tpsa: 55.48
Logp: -0.6575
H Acceptors: 3
H Donors: 2
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:
C₆H₁₃NO₂
Molecular Weight:
131.17
Synonyms:
None
SMILES:
OC[C@H](N)C1COCC1
Tpsa:
55.48
Logp:
-0.6575
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
2