CS-0674761
(S)-3-Amino-7-ethynyl-5-methyl-2,3-dihydrobenzo[b][1,4]oxazepin-4(5H)-one
Manufacturer: ChemScene
CAS Number: 2911582-54-0
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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
C₁₂H₁₂N₂O₂
Molecular Weight
216.24
Synonyms
None
SMILES
O=C1[C@@H](N)COC2=CC=C(C#C)C=C2N1C
Tpsa
55.56
Logp
0.3504
H Acceptors
3
H Donors
1
Rotatable Bonds
0
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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: C₁₂H₁₂N₂O₂
Molecular Weight: 216.24
Synonyms: None
SMILES: O=C1[C@@H](N)COC2=CC=C(C#C)C=C2N1C
Tpsa: 55.56
Logp: 0.3504
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:
C₁₂H₁₂N₂O₂
Molecular Weight:
216.24
Synonyms:
None
SMILES:
O=C1[C@@H](N)COC2=CC=C(C#C)C=C2N1C
Tpsa:
55.56
Logp:
0.3504
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: C₈H₇BrN₂O₄
Molecular Weight: 275.06
Synonyms: None
SMILES: O=C(C1=C([N+]([O-])=O)C=C(Br)N=C1)OCC
Tpsa: 82.33
Logp: 1.929
H Acceptors: 5
H Donors: 0
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:
C₈H₇BrN₂O₄
Molecular Weight:
275.06
Synonyms:
None
SMILES:
O=C(C1=C([N+]([O-])=O)C=C(Br)N=C1)OCC
Tpsa:
82.33
Logp:
1.929
H Acceptors:
5
H Donors:
0
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: C₉H₁₁BrClN₃O₂
Molecular Weight: 308.56
Synonyms: None
SMILES: CN1C2=NC(Br)=CC=C2OC[C@@H](C1=O)N.Cl
Tpsa: 68.45
Logp: 0.9484
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:
C₉H₁₁BrClN₃O₂
Molecular Weight:
308.56
Synonyms:
None
SMILES:
CN1C2=NC(Br)=CC=C2OC[C@@H](C1=O)N.Cl
Tpsa:
68.45
Logp:
0.9484
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: C₉H₁₆N₂OS
Molecular Weight: 200.30
Synonyms: None
SMILES: N[C@@H](C)C1=NC(C(C)(OC)C)=CS1
Tpsa: 48.14
Logp: 2.0443
H Acceptors: 4
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:
C₉H₁₆N₂OS
Molecular Weight:
200.30
Synonyms:
None
SMILES:
N[C@@H](C)C1=NC(C(C)(OC)C)=CS1
Tpsa:
48.14
Logp:
2.0443
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3