CS-0530706
tert-Butyl 3-amino-3-cyanoazepane-1-carboxylate
Manufacturer: ChemScene
CAS Number: 2091702-69-9
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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
C₁₂H₂₁N₃O₂
Molecular Weight
239.31
Synonyms
None
SMILES
O=C(N1CC(C#N)(N)CCCC1)OC(C)(C)C
Tpsa
79.35
Logp
1.62848
H Acceptors
4
H Donors
1
Rotatable Bonds
0
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: C₁₂H₂₁N₃O₂
Molecular Weight: 239.31
Synonyms: None
SMILES: O=C(N1CC(C#N)(N)CCCC1)OC(C)(C)C
Tpsa: 79.35
Logp: 1.62848
H Acceptors: 4
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:
C₁₂H₂₁N₃O₂
Molecular Weight:
239.31
Synonyms:
None
SMILES:
O=C(N1CC(C#N)(N)CCCC1)OC(C)(C)C
Tpsa:
79.35
Logp:
1.62848
H Acceptors:
4
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: C₈H₆F₂N₂
Molecular Weight: 168.14
Synonyms: 3-Cyano-2,6-difluorobenzylamine
SMILES: N#CC1=CC=C(F)C(CN)=C1F
Tpsa: 49.81
Logp: 1.29518
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:
C₈H₆F₂N₂
Molecular Weight:
168.14
Synonyms:
3-Cyano-2,6-difluorobenzylamine
SMILES:
N#CC1=CC=C(F)C(CN)=C1F
Tpsa:
49.81
Logp:
1.29518
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: C₆H₆F₂N₂
Molecular Weight: 144.12
Synonyms: (2,6-difluoropyridin-3-yl)methyl]amine
SMILES: NCC1=CC=C(F)N=C1F
Tpsa: 38.91
Logp: 0.8185
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:
C₆H₆F₂N₂
Molecular Weight:
144.12
Synonyms:
(2,6-difluoropyridin-3-yl)methyl]amine
SMILES:
NCC1=CC=C(F)N=C1F
Tpsa:
38.91
Logp:
0.8185
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: C₈H₁₆O₃
Molecular Weight: 160.21
Synonyms: None
SMILES: C[C@H](O)CCCC1OCCO1
Tpsa: 38.69
Logp: 0.9104
H Acceptors: 3
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:
C₈H₁₆O₃
Molecular Weight:
160.21
Synonyms:
None
SMILES:
C[C@H](O)CCCC1OCCO1
Tpsa:
38.69
Logp:
0.9104
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
4