CS-0609696
Methyl 3-ethynyl-5-nitrobenzoate
Manufacturer: ChemScene
CAS Number: 1192472-44-8
The price for this product is unavailable. Please request a quote
Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₀H₇NO₄
Molecular Weight
205.17
Synonyms
None
SMILES
O=C(OC)C1=CC([N+]([O-])=O)=CC(C#C)=C1
Tpsa
69.44
Logp
1.3627
H Acceptors
4
H Donors
0
Rotatable Bonds
2
Related Products
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
Compare Similar Items
Show Difference
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₇NO₄
Molecular Weight: 205.17
Synonyms: None
SMILES: O=C(OC)C1=CC([N+]([O-])=O)=CC(C#C)=C1
Tpsa: 69.44
Logp: 1.3627
H Acceptors: 4
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:
C₁₀H₇NO₄
Molecular Weight:
205.17
Synonyms:
None
SMILES:
O=C(OC)C1=CC([N+]([O-])=O)=CC(C#C)=C1
Tpsa:
69.44
Logp:
1.3627
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: 4°C, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₃Cl₂N
Molecular Weight: 172.01
Synonyms: None
SMILES: C#CC1=CN=C(Cl)C=C1Cl
Tpsa: 12.89
Logp: 2.3697
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 0
Purity:
97%
MDL No:
None
Storage:
4°C, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₃Cl₂N
Molecular Weight:
172.01
Synonyms:
None
SMILES:
C#CC1=CN=C(Cl)C=C1Cl
Tpsa:
12.89
Logp:
2.3697
H Acceptors:
1
H Donors:
0
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: C₈H₇NO
Molecular Weight: 133.15
Synonyms: None
SMILES: COC1=C(C#C)C=CN=C1
Tpsa: 22.12
Logp: 1.0715
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:
C₈H₇NO
Molecular Weight:
133.15
Synonyms:
None
SMILES:
COC1=C(C#C)C=CN=C1
Tpsa:
22.12
Logp:
1.0715
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: C₈H₆N₂O₂
Molecular Weight: 162.15
Synonyms: 2-Pyrimidinecarboxylic acid, 5-ethynyl-, methyl ester
SMILES: O=C(C1=NC=C(C#C)C=N1)OC
Tpsa: 52.08
Logp: 0.2445
H Acceptors: 4
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:
C₈H₆N₂O₂
Molecular Weight:
162.15
Synonyms:
2-Pyrimidinecarboxylic acid, 5-ethynyl-, methyl ester
SMILES:
O=C(C1=NC=C(C#C)C=N1)OC
Tpsa:
52.08
Logp:
0.2445
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
1