CS-0656035
Benzyl 3-fluoro-6-methoxy-2-methyl-5-nitrobenzoate
Manufacturer: ChemScene
CAS Number: 2913212-45-8
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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
C₁₆H₁₄FNO₅
Molecular Weight
319.28
Synonyms
None
SMILES
O=C(OCC1=CC=CC=C1)C2=C(OC)C([N+]([O-])=O)=CC(F)=C2C
Tpsa
78.67
Logp
3.40792
H Acceptors
5
H Donors
0
Rotatable Bonds
5
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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: C₁₆H₁₄FNO₅
Molecular Weight: 319.28
Synonyms: None
SMILES: O=C(OCC1=CC=CC=C1)C2=C(OC)C([N+]([O-])=O)=CC(F)=C2C
Tpsa: 78.67
Logp: 3.40792
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₄FNO₅
Molecular Weight:
319.28
Synonyms:
None
SMILES:
O=C(OCC1=CC=CC=C1)C2=C(OC)C([N+]([O-])=O)=CC(F)=C2C
Tpsa:
78.67
Logp:
3.40792
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₆BClN₂O₂
Molecular Weight: 196.40
Synonyms: None
SMILES: ClC1=C(B(O)O)C=NC2=C1C=CN2
Tpsa: 69.14
Logp: -0.1039
H Acceptors: 3
H Donors: 3
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:
C₇H₆BClN₂O₂
Molecular Weight:
196.40
Synonyms:
None
SMILES:
ClC1=C(B(O)O)C=NC2=C1C=CN2
Tpsa:
69.14
Logp:
-0.1039
H Acceptors:
3
H Donors:
3
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: C₁₈H₂₆N₃O₅P
Molecular Weight: 395.39
Synonyms: None
SMILES: O=C(OC(C)(C)C)N(C1=CC=C(P(C)(C)=O)N=C1C#N)C(OC(C)(C)C)=O
Tpsa: 109.59
Logp: 3.87788
H Acceptors: 7
H Donors: 0
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:
C₁₈H₂₆N₃O₅P
Molecular Weight:
395.39
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N(C1=CC=C(P(C)(C)=O)N=C1C#N)C(OC(C)(C)C)=O
Tpsa:
109.59
Logp:
3.87788
H Acceptors:
7
H Donors:
0
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: C₇H₅IN₂S
Molecular Weight: 276.10
Synonyms: None
SMILES: NC1=C2N=CSC2=C(I)C=C1
Tpsa: 38.91
Logp: 2.4831
H Acceptors: 3
H Donors: 1
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:
C₇H₅IN₂S
Molecular Weight:
276.10
Synonyms:
None
SMILES:
NC1=C2N=CSC2=C(I)C=C1
Tpsa:
38.91
Logp:
2.4831
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0