CS-1161671
1-(2-(Difluoromethyl)-4-nitrophenyl)ethan-1-one
Manufacturer: ChemScene
CAS Number: 2386346-52-5
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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
C₉H₇F₂NO₃
Molecular Weight
215.16
Synonyms
None
SMILES
O=C(C1=CC=C(C=C1C(F)F)N(=O)=O)C
Tpsa
60.21
Logp
2.735
H Acceptors
3
H Donors
0
Rotatable Bonds
3
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: C₉H₇F₂NO₃
Molecular Weight: 215.16
Synonyms: None
SMILES: O=C(C1=CC=C(C=C1C(F)F)N(=O)=O)C
Tpsa: 60.21
Logp: 2.735
H Acceptors: 3
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:
C₉H₇F₂NO₃
Molecular Weight:
215.16
Synonyms:
None
SMILES:
O=C(C1=CC=C(C=C1C(F)F)N(=O)=O)C
Tpsa:
60.21
Logp:
2.735
H Acceptors:
3
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: C₁₃H₁₇N₃S
Molecular Weight: 247.36
Synonyms: None
SMILES: N1=C(C=C(N1C2CNCCC2)C)C=3SC=CC3
Tpsa: 29.85
Logp: 2.84452
H Acceptors: 4
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:
C₁₃H₁₇N₃S
Molecular Weight:
247.36
Synonyms:
None
SMILES:
N1=C(C=C(N1C2CNCCC2)C)C=3SC=CC3
Tpsa:
29.85
Logp:
2.84452
H Acceptors:
4
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: C₈H₁₂F₃N₃O
Molecular Weight: 223.20
Synonyms: None
SMILES: FC(F)(F)C1=NN(C(=C1)CN)CCOC
Tpsa: 53.07
Logp: 1.007
H Acceptors: 4
H Donors: 1
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:
C₈H₁₂F₃N₃O
Molecular Weight:
223.20
Synonyms:
None
SMILES:
FC(F)(F)C1=NN(C(=C1)CN)CCOC
Tpsa:
53.07
Logp:
1.007
H Acceptors:
4
H Donors:
1
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: C₈H₁₃N₃O₃
Molecular Weight: 199.21
Synonyms: None
SMILES: O=C1C=C(NC(=O)N1C)NCCOC
Tpsa: 76.12
Logp: -0.8681
H Acceptors: 5
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:
C₈H₁₃N₃O₃
Molecular Weight:
199.21
Synonyms:
None
SMILES:
O=C1C=C(NC(=O)N1C)NCCOC
Tpsa:
76.12
Logp:
-0.8681
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
4