CS-0650091
3-Amino-4-(3,3-diethoxyprop-1-yn-1-yl)benzonitrile
Manufacturer: ChemScene
CAS Number: 2577245-76-0
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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
C₁₄H₁₆N₂O₂
Molecular Weight
244.29
Synonyms
None
SMILES
N#CC1=CC=C(C#CC(OCC)OCC)C(N)=C1
Tpsa
68.27
Logp
1.89108
H Acceptors
4
H Donors
1
Rotatable Bonds
4
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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: C₁₄H₁₆N₂O₂
Molecular Weight: 244.29
Synonyms: None
SMILES: N#CC1=CC=C(C#CC(OCC)OCC)C(N)=C1
Tpsa: 68.27
Logp: 1.89108
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₆N₂O₂
Molecular Weight:
244.29
Synonyms:
None
SMILES:
N#CC1=CC=C(C#CC(OCC)OCC)C(N)=C1
Tpsa:
68.27
Logp:
1.89108
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₅NO
Molecular Weight: 129.20
Synonyms: None
SMILES: OC1C(C)(C)C(CN)C1
Tpsa: 46.25
Logp: 0.3521
H Acceptors: 2
H Donors: 2
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:
C₇H₁₅NO
Molecular Weight:
129.20
Synonyms:
None
SMILES:
OC1C(C)(C)C(CN)C1
Tpsa:
46.25
Logp:
0.3521
H Acceptors:
2
H Donors:
2
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: C₁₂H₂₁BN₂O₃
Molecular Weight: 252.12
Synonyms: None
SMILES: CC1(C)C(C)(C)OB(C2=NN(CCOC)C=C2)O1
Tpsa: 45.51
Logp: 0.8287
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₂₁BN₂O₃
Molecular Weight:
252.12
Synonyms:
None
SMILES:
CC1(C)C(C)(C)OB(C2=NN(CCOC)C=C2)O1
Tpsa:
45.51
Logp:
0.8287
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₁ClN₂O₄
Molecular Weight: 258.66
Synonyms: None
SMILES: O=C(C1=CC([N+]([O-])=O)=C(Cl)N=C1)OC(C)(C)C
Tpsa: 82.33
Logp: 2.5985
H Acceptors: 5
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:
C₁₀H₁₁ClN₂O₄
Molecular Weight:
258.66
Synonyms:
None
SMILES:
O=C(C1=CC([N+]([O-])=O)=C(Cl)N=C1)OC(C)(C)C
Tpsa:
82.33
Logp:
2.5985
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
2