CS-0768050
4-Benzyl-1,4-diazepan-5-one
Manufacturer: ChemScene
CAS Number: 1211569-25-3
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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
C₁₂H₁₆N₂O
Molecular Weight
204.27
Synonyms
None
SMILES
O=C1CCNCCN1CC1=CC=CC=C1
Tpsa
32.34
Logp
1.0085
H Acceptors
2
H Donors
1
Rotatable Bonds
2
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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
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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: C₁₂H₁₆N₂O
Molecular Weight: 204.27
Synonyms: None
SMILES: O=C1CCNCCN1CC1=CC=CC=C1
Tpsa: 32.34
Logp: 1.0085
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₆N₂O
Molecular Weight:
204.27
Synonyms:
None
SMILES:
O=C1CCNCCN1CC1=CC=CC=C1
Tpsa:
32.34
Logp:
1.0085
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₄BrN₃O₃
Molecular Weight: 258.03
Synonyms: None
SMILES: OC(=O)C1=CNC2=C(Br)C=NN2C1=O
Tpsa: 87.46
Logp: 0.4833
H Acceptors: 4
H Donors: 2
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:
C₇H₄BrN₃O₃
Molecular Weight:
258.03
Synonyms:
None
SMILES:
OC(=O)C1=CNC2=C(Br)C=NN2C1=O
Tpsa:
87.46
Logp:
0.4833
H Acceptors:
4
H Donors:
2
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: C₆H₉N₃O₂
Molecular Weight: 155.15
Synonyms: None
SMILES: NC(CC1=NC=CN1)C(O)=O
Tpsa: 92
Logp: -0.6359
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 3
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₉N₃O₂
Molecular Weight:
155.15
Synonyms:
None
SMILES:
NC(CC1=NC=CN1)C(O)=O
Tpsa:
92
Logp:
-0.6359
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
3
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₅N₃O
Molecular Weight: 159.14
Synonyms: None
SMILES: N#CCC1=NOC2=NC=CC=C12
Tpsa: 62.71
Logp: 1.28888
H Acceptors: 4
H Donors: 0
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:
C₈H₅N₃O
Molecular Weight:
159.14
Synonyms:
None
SMILES:
N#CCC1=NOC2=NC=CC=C12
Tpsa:
62.71
Logp:
1.28888
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
1