CS-1024961
4-(3-Amino-5-bromo-1H-1,2,4-triazol-1-yl)butanenitrile
Manufacturer: ChemScene
CAS Number: 1697751-02-2
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Purity
95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₆H₈BrN₅
Molecular Weight
230.07
Synonyms
None
SMILES
N#CCCCN1N=C(N=C1Br)N
Tpsa
80.52
Logp
0.92658
H Acceptors
5
H Donors
1
Rotatable Bonds
3
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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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₈BrN₅
Molecular Weight: 230.07
Synonyms: None
SMILES: N#CCCCN1N=C(N=C1Br)N
Tpsa: 80.52
Logp: 0.92658
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₈BrN₅
Molecular Weight:
230.07
Synonyms:
None
SMILES:
N#CCCCN1N=C(N=C1Br)N
Tpsa:
80.52
Logp:
0.92658
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
3
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₆Br₂F₃N
Molecular Weight: 332.94
Synonyms: None
SMILES: FC(F)(F)CNC=1C(Br)=CC=CC1Br
Tpsa: 12.03
Logp: 4.1858
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₆Br₂F₃N
Molecular Weight:
332.94
Synonyms:
None
SMILES:
FC(F)(F)CNC=1C(Br)=CC=CC1Br
Tpsa:
12.03
Logp:
4.1858
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₆Br₂N₂O
Molecular Weight: 329.98
Synonyms: None
SMILES: O=CC1=CC=C(C=C1Br)N2N=CC(Br)=C2
Tpsa: 34.89
Logp: 3.2098
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₆Br₂N₂O
Molecular Weight:
329.98
Synonyms:
None
SMILES:
O=CC1=CC=C(C=C1Br)N2N=CC(Br)=C2
Tpsa:
34.89
Logp:
3.2098
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₉NO₅
Molecular Weight: 233.26
Synonyms: None
SMILES: O=C(OC(C)(C)C)NCC(OC)CC(=O)O
Tpsa: 84.86
Logp: 1.0008
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 5
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₉NO₅
Molecular Weight:
233.26
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)NCC(OC)CC(=O)O
Tpsa:
84.86
Logp:
1.0008
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
5