CS-1062911
(S)-3-(4-Chlorobenzyl)-2,3,4,5-tetrahydrobenzo[f][1,4]oxazepine-7-carbonitrile
Manufacturer: ChemScene
CAS Number: 2569222-36-0
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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
C₁₇H₁₅ClN₂O
Molecular Weight
298.77
Synonyms
None
SMILES
C(#N)C=1C=C2C(OC[C@H](CC3=CC=C(Cl)C=C3)NC2)=CC1
Tpsa
45.05
Logp
3.30498
H Acceptors
3
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
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: C₁₇H₁₅ClN₂O
Molecular Weight: 298.77
Synonyms: None
SMILES: C(#N)C=1C=C2C(OC[C@H](CC3=CC=C(Cl)C=C3)NC2)=CC1
Tpsa: 45.05
Logp: 3.30498
H Acceptors: 3
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:
C₁₇H₁₅ClN₂O
Molecular Weight:
298.77
Synonyms:
None
SMILES:
C(#N)C=1C=C2C(OC[C@H](CC3=CC=C(Cl)C=C3)NC2)=CC1
Tpsa:
45.05
Logp:
3.30498
H Acceptors:
3
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: C₉H₁₂N₄O
Molecular Weight: 192.22
Synonyms: None
SMILES: N#CCC1(N2N=CC(O)=C2)CN(C)C1
Tpsa: 65.08
Logp: 0.14308
H Acceptors: 5
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:
C₉H₁₂N₄O
Molecular Weight:
192.22
Synonyms:
None
SMILES:
N#CCC1(N2N=CC(O)=C2)CN(C)C1
Tpsa:
65.08
Logp:
0.14308
H Acceptors:
5
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: C₁₂H₁₄N₂O
Molecular Weight: 202.25
Synonyms: None
SMILES: O=C1NCC2(C3=CC=C(N)C=C13)CCC2
Tpsa: 55.12
Logp: 1.4339
H Acceptors: 2
H Donors: 2
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:
C₁₂H₁₄N₂O
Molecular Weight:
202.25
Synonyms:
None
SMILES:
O=C1NCC2(C3=CC=C(N)C=C13)CCC2
Tpsa:
55.12
Logp:
1.4339
H Acceptors:
2
H Donors:
2
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: C₁₅H₂₂N₂O₂
Molecular Weight: 262.35
Synonyms: None
SMILES: O=C(OCC=1C=CC=CC1)N2CC(N)CC(C2)CC
Tpsa: 55.56
Logp: 2.3824
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:
C₁₅H₂₂N₂O₂
Molecular Weight:
262.35
Synonyms:
None
SMILES:
O=C(OCC=1C=CC=CC1)N2CC(N)CC(C2)CC
Tpsa:
55.56
Logp:
2.3824
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
3