CS-0877550
1,1,1-Trifluoro-4-[4-[(4-fluorophenyl)methyl]hexahydro-1H-1,4-diazepin-1-yl]-3-buten-2-one
Manufacturer: ChemScene
CAS Number: 646455-46-1
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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
C₁₆H₁₈F₄N₂O
Molecular Weight
330.32
Synonyms
None
SMILES
O=C(C=CN1CCN(CC2=CC=C(F)C=C2)CCC1)C(F)(F)F
Tpsa
23.55
Logp
2.9785
H Acceptors
3
H Donors
0
Rotatable Bonds
4
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 646455-46-1 | 1,1,1-Trifluoro-4-[4-(4-fluorobenzyl)homopiperazin-1-yl]but-3-en-2-one | 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: C₁₆H₁₈F₄N₂O
Molecular Weight: 330.32
Synonyms: None
SMILES: O=C(C=CN1CCN(CC2=CC=C(F)C=C2)CCC1)C(F)(F)F
Tpsa: 23.55
Logp: 2.9785
H Acceptors: 3
H Donors: 0
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:
C₁₆H₁₈F₄N₂O
Molecular Weight:
330.32
Synonyms:
None
SMILES:
O=C(C=CN1CCN(CC2=CC=C(F)C=C2)CCC1)C(F)(F)F
Tpsa:
23.55
Logp:
2.9785
H Acceptors:
3
H Donors:
0
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: C₉H₈BrF₂NO
Molecular Weight: 264.07
Synonyms: None
SMILES: CC(C(=O)NC1=C(C=CC=C1F)F)Br
Tpsa: 29.1
Logp: 2.6867
H Acceptors: 1
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:
C₉H₈BrF₂NO
Molecular Weight:
264.07
Synonyms:
None
SMILES:
CC(C(=O)NC1=C(C=CC=C1F)F)Br
Tpsa:
29.1
Logp:
2.6867
H Acceptors:
1
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: C₈H₁₁F₃N₂
Molecular Weight: 192.18
Synonyms: None
SMILES: CC1=CN(N=C1C(F)(F)F)C(C)C
Tpsa: 17.82
Logp: 2.79122
H Acceptors: 2
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:
C₈H₁₁F₃N₂
Molecular Weight:
192.18
Synonyms:
None
SMILES:
CC1=CN(N=C1C(F)(F)F)C(C)C
Tpsa:
17.82
Logp:
2.79122
H Acceptors:
2
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: C₁₄H₁₇F₃N₂O₂
Molecular Weight: 302.29
Synonyms: None
SMILES: CC1CN(CC(O1)C)C(=O)C2=C(N=C(C=C2)C(F)(F)F)C
Tpsa: 42.43
Logp: 2.65822
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:
C₁₄H₁₇F₃N₂O₂
Molecular Weight:
302.29
Synonyms:
None
SMILES:
CC1CN(CC(O1)C)C(=O)C2=C(N=C(C=C2)C(F)(F)F)C
Tpsa:
42.43
Logp:
2.65822
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1