CS-0545855
(Z)-3-(2-oxo-2-phenylethylidene)-1,4-diazocan-2-one
Manufacturer: ChemScene
CAS Number: 893612-85-6
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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
C₁₄H₁₆N₂O₂
Molecular Weight
244.29
Synonyms
3-[2-Oxo-2-phenyl-eth-(Z)-ylidene]-[1,4]diazocan-2-one
SMILES
C1CCNC(=O)/C(=C/C(=O)C2=CC=CC=C2)/NC1
Tpsa
58.2
Logp
1.2528
H Acceptors
3
H Donors
2
Rotatable Bonds
2
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 893612-85-6 | 1,4-Diazocin-2(1H)-one,hexahydro-3-(2-oxo-2-phenylethylidene)- | A2B Chem | -- |
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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: C₁₄H₁₆N₂O₂
Molecular Weight: 244.29
Synonyms: 3-[2-Oxo-2-phenyl-eth-(Z)-ylidene]-[1,4]diazocan-2-one
SMILES: C1CCNC(=O)/C(=C/C(=O)C2=CC=CC=C2)/NC1
Tpsa: 58.2
Logp: 1.2528
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:
C₁₄H₁₆N₂O₂
Molecular Weight:
244.29
Synonyms:
3-[2-Oxo-2-phenyl-eth-(Z)-ylidene]-[1,4]diazocan-2-one
SMILES:
C1CCNC(=O)/C(=C/C(=O)C2=CC=CC=C2)/NC1
Tpsa:
58.2
Logp:
1.2528
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: C₁₅H₁₂FNO₄
Molecular Weight: 289.26
Synonyms: None
SMILES: C1CC2=C(C(=C(N2C1)C3=CC=C(C=C3)F)C(=O)O)C(=O)O
Tpsa: 79.53
Logp: 2.6368
H Acceptors: 3
H Donors: 2
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:
C₁₅H₁₂FNO₄
Molecular Weight:
289.26
Synonyms:
None
SMILES:
C1CC2=C(C(=C(N2C1)C3=CC=C(C=C3)F)C(=O)O)C(=O)O
Tpsa:
79.53
Logp:
2.6368
H Acceptors:
3
H Donors:
2
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: C₁₂H₁₅NO₂S
Molecular Weight: 237.32
Synonyms: S-(4-methylphenyl) morpholine-4-carbothioate
SMILES: CC1=CC=C(C=C1)SC(=O)N2CCOCC2
Tpsa: 29.54
Logp: 2.53932
H Acceptors: 3
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:
C₁₂H₁₅NO₂S
Molecular Weight:
237.32
Synonyms:
S-(4-methylphenyl) morpholine-4-carbothioate
SMILES:
CC1=CC=C(C=C1)SC(=O)N2CCOCC2
Tpsa:
29.54
Logp:
2.53932
H Acceptors:
3
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: C₁₆H₁₄ClNO₂
Molecular Weight: 287.74
Synonyms: 2-Chloro-6-(3-hydroxypropylamino)-1-phenalenone
SMILES: C1=CC2=C(C=CC3=C2C(=C1)C(=O)C(=C3)Cl)NCCCO
Tpsa: 49.33
Logp: 3.4101
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₄ClNO₂
Molecular Weight:
287.74
Synonyms:
2-Chloro-6-(3-hydroxypropylamino)-1-phenalenone
SMILES:
C1=CC2=C(C=CC3=C2C(=C1)C(=O)C(=C3)Cl)NCCCO
Tpsa:
49.33
Logp:
3.4101
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
4