CS-0492685
Methyl 2-((tert-butoxycarbonyl)amino)but-3-ynoate
Manufacturer: ChemScene
CAS Number: 389599-84-2
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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
C₁₀H₁₅NO₄
Molecular Weight
213.23
Synonyms
3-Butynoicacid,2-[[(1,1-dimethylethoxy)carbonyl]amino]-,methylester(9CI)
SMILES
COC(=O)C(C#C)NC(=O)OC(C)(C)C
Tpsa
64.63
Logp
0.6859
H Acceptors
4
H Donors
1
Rotatable Bonds
2
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
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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: C₁₀H₁₅NO₄
Molecular Weight: 213.23
Synonyms: 3-Butynoicacid,2-[[(1,1-dimethylethoxy)carbonyl]amino]-,methylester(9CI)
SMILES: COC(=O)C(C#C)NC(=O)OC(C)(C)C
Tpsa: 64.63
Logp: 0.6859
H Acceptors: 4
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:
C₁₀H₁₅NO₄
Molecular Weight:
213.23
Synonyms:
3-Butynoicacid,2-[[(1,1-dimethylethoxy)carbonyl]amino]-,methylester(9CI)
SMILES:
COC(=O)C(C#C)NC(=O)OC(C)(C)C
Tpsa:
64.63
Logp:
0.6859
H Acceptors:
4
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: C₉H₈ClNO₃
Molecular Weight: 213.62
Synonyms: None
SMILES: ClCC(=O)C1=CC(C(N)=O)=C(O)C=C1
Tpsa: 80.39
Logp: 0.9126
H Acceptors: 3
H Donors: 2
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:
C₉H₈ClNO₃
Molecular Weight:
213.62
Synonyms:
None
SMILES:
ClCC(=O)C1=CC(C(N)=O)=C(O)C=C1
Tpsa:
80.39
Logp:
0.9126
H Acceptors:
3
H Donors:
2
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: C₇H₆FN₃
Molecular Weight: 151.14
Synonyms: 7-amino-4-fluoro-6-azaindole
SMILES: NC1=C2C(C=CN2)=C(F)C=N1
Tpsa: 54.7
Logp: 1.2842
H Acceptors: 2
H Donors: 2
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:
C₇H₆FN₃
Molecular Weight:
151.14
Synonyms:
7-amino-4-fluoro-6-azaindole
SMILES:
NC1=C2C(C=CN2)=C(F)C=N1
Tpsa:
54.7
Logp:
1.2842
H Acceptors:
2
H Donors:
2
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: C₈H₆F₃N₃
Molecular Weight: 201.15
Synonyms: 7-AMino-4-trifluoroMethyl-6-azaindole
SMILES: NC1=C2C(C=CN2)=C(C=N1)C(F)(F)F
Tpsa: 54.7
Logp: 2.1639
H Acceptors: 2
H Donors: 2
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:
C₈H₆F₃N₃
Molecular Weight:
201.15
Synonyms:
7-AMino-4-trifluoroMethyl-6-azaindole
SMILES:
NC1=C2C(C=CN2)=C(C=N1)C(F)(F)F
Tpsa:
54.7
Logp:
2.1639
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
0