CS-0734609
1-(2,4-Difluorophenyl)-2-thiocyanatoethanone
Manufacturer: ChemScene
CAS Number: 887625-49-2
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Purity
98%
MDL No
MFCD03453109
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₉H₅F₂NOS
Molecular Weight
213.20
Synonyms
None
SMILES
FC1=CC(F)=C(C=C1)C(=O)CSC#N
Tpsa
40.86
Logp
2.36178
H Acceptors
3
H Donors
0
Rotatable Bonds
3
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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: MFCD03453109
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₅F₂NOS
Molecular Weight: 213.20
Synonyms: None
SMILES: FC1=CC(F)=C(C=C1)C(=O)CSC#N
Tpsa: 40.86
Logp: 2.36178
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
MFCD03453109
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₅F₂NOS
Molecular Weight:
213.20
Synonyms:
None
SMILES:
FC1=CC(F)=C(C=C1)C(=O)CSC#N
Tpsa:
40.86
Logp:
2.36178
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: C₃H₃Br₂N₃O
Molecular Weight: 256.88
Synonyms: None
SMILES: NC1=NNC(=O)C1(Br)Br
Tpsa: 67.48
Logp: -0.1255
H Acceptors: 3
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:
C₃H₃Br₂N₃O
Molecular Weight:
256.88
Synonyms:
None
SMILES:
NC1=NNC(=O)C1(Br)Br
Tpsa:
67.48
Logp:
-0.1255
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
0
Purity: 95%
MDL No: MFCD08436997
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₃BrClN₃
Molecular Weight: 326.62
Synonyms: None
SMILES: ClC1=CC=C2C(=C1)N=CC(Br)=C2N1CCNCC1
Tpsa: 28.16
Logp: 3.0603
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
95%
MDL No:
MFCD08436997
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₃BrClN₃
Molecular Weight:
326.62
Synonyms:
None
SMILES:
ClC1=CC=C2C(=C1)N=CC(Br)=C2N1CCNCC1
Tpsa:
28.16
Logp:
3.0603
H Acceptors:
3
H Donors:
1
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: C₁₂H₁₃NO₄
Molecular Weight: 235.24
Synonyms: None
SMILES: COC1=CC(=O)NC2=CC(OC)=C(OC)C=C12
Tpsa: 60.55
Logp: 1.5539
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:
C₁₂H₁₃NO₄
Molecular Weight:
235.24
Synonyms:
None
SMILES:
COC1=CC(=O)NC2=CC(OC)=C(OC)C=C12
Tpsa:
60.55
Logp:
1.5539
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3