CS-0896559
Methyl 2-ethynyl-5-nitrobenzoate
Manufacturer: ChemScene
CAS Number: 239065-10-2
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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
C₁₀H₇NO₄
Molecular Weight
205.17
Synonyms
None
SMILES
O=C(OC)C1=CC([N+]([O-])=O)=CC=C1C#C
Tpsa
69.44
Logp
1.3627
H Acceptors
4
H Donors
0
Rotatable Bonds
2
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: C₁₀H₇NO₄
Molecular Weight: 205.17
Synonyms: None
SMILES: O=C(OC)C1=CC([N+]([O-])=O)=CC=C1C#C
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=C1C#C
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: C₇H₈FNO
Molecular Weight: 141.14
Synonyms: None
SMILES: O[C@@H](C)C1=CC(F)=NC=C1
Tpsa: 33.12
Logp: 1.274
H Acceptors: 2
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:
C₇H₈FNO
Molecular Weight:
141.14
Synonyms:
None
SMILES:
O[C@@H](C)C1=CC(F)=NC=C1
Tpsa:
33.12
Logp:
1.274
H Acceptors:
2
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: C₁₄H₁₈BNO₆
Molecular Weight: 307.11
Synonyms: None
SMILES: O=C(OC)C1=CC=CC([N+]([O-])=O)=C1B2OC(C)(C)C(C)(C)O2
Tpsa: 87.9
Logp: 1.6806
H Acceptors: 6
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:
C₁₄H₁₈BNO₆
Molecular Weight:
307.11
Synonyms:
None
SMILES:
O=C(OC)C1=CC=CC([N+]([O-])=O)=C1B2OC(C)(C)C(C)(C)O2
Tpsa:
87.9
Logp:
1.6806
H Acceptors:
6
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: C₁₄H₂₀BNO₄
Molecular Weight: 277.12
Synonyms: None
SMILES: O=C(OC)C1=CC=CC(N)=C1B2OC(C)(C)C(C)(C)O2
Tpsa: 70.78
Logp: 1.3546
H Acceptors: 5
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:
C₁₄H₂₀BNO₄
Molecular Weight:
277.12
Synonyms:
None
SMILES:
O=C(OC)C1=CC=CC(N)=C1B2OC(C)(C)C(C)(C)O2
Tpsa:
70.78
Logp:
1.3546
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2