CS-0145632
Methyl (E)-3-(2-amino-3-fluorophenyl)acrylate
Manufacturer: ChemScene
CAS Number: 690664-20-1
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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
C₁₀H₁₀FNO₂
Molecular Weight
195.19
Synonyms
None
SMILES
O=C(OC)/C=C/C1=CC=CC(F)=C1N
Tpsa
52.32
Logp
1.5941
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: C₁₀H₁₀FNO₂
Molecular Weight: 195.19
Synonyms: None
SMILES: O=C(OC)/C=C/C1=CC=CC(F)=C1N
Tpsa: 52.32
Logp: 1.5941
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:
C₁₀H₁₀FNO₂
Molecular Weight:
195.19
Synonyms:
None
SMILES:
O=C(OC)/C=C/C1=CC=CC(F)=C1N
Tpsa:
52.32
Logp:
1.5941
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: -20°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₂₃ClN₅O₇P
Molecular Weight: 463.81
Synonyms: None
SMILES: ClC1=NC(N([C@@H]([C@H](O)[C@@H]2O)O[C@@H]2COCP(O)(O)=O)N=C3)=C3C(NC4CCCC4)=N1
Tpsa: 172.08
Logp: 0.6052
H Acceptors: 10
H Donors: 5
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
-20°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₂₃ClN₅O₇P
Molecular Weight:
463.81
Synonyms:
None
SMILES:
ClC1=NC(N([C@@H]([C@H](O)[C@@H]2O)O[C@@H]2COCP(O)(O)=O)N=C3)=C3C(NC4CCCC4)=N1
Tpsa:
172.08
Logp:
0.6052
H Acceptors:
10
H Donors:
5
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₉H₁₇FN₆O
Molecular Weight: 364.38
Synonyms: None
SMILES: O=C(C(N1)=CC2=C1C=C(F)C=C2)NC3=NC(C4=NN=CN4C(C)C)=CC=C3
Tpsa: 88.49
Logp: 3.7937
H Acceptors: 5
H Donors: 2
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₁₇FN₆O
Molecular Weight:
364.38
Synonyms:
None
SMILES:
O=C(C(N1)=CC2=C1C=C(F)C=C2)NC3=NC(C4=NN=CN4C(C)C)=CC=C3
Tpsa:
88.49
Logp:
3.7937
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
4
Purity: 98%
MDL No: MFCD13368249
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₃ClN₄O₂
Molecular Weight: 244.68
Synonyms: None
SMILES: O=[N+](C1=CC=C(N2CCNCC2)C=N1)[O-].[H]Cl
Tpsa: 71.3
Logp: 0.8212
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD13368249
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₃ClN₄O₂
Molecular Weight:
244.68
Synonyms:
None
SMILES:
O=[N+](C1=CC=C(N2CCNCC2)C=N1)[O-].[H]Cl
Tpsa:
71.3
Logp:
0.8212
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2