CS-0565169
1,2-Bis((1H-1,2,4-triazol-1-yl)methyl)benzene
Manufacturer: ChemScene
CAS Number: 1196989-82-8
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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
C₁₂H₁₂N₆
Molecular Weight
240.26
Synonyms
1,2-bis((4H-1,2,4-triazol-4-yl)methyl)benzene
SMILES
N1(CC2=C(CN3N=CN=C3)C=CC=C2)N=CN=C1
Tpsa
61.42
Logp
0.9662
H Acceptors
6
H Donors
0
Rotatable Bonds
4
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: C₁₂H₁₂N₆
Molecular Weight: 240.26
Synonyms: 1,2-bis((4H-1,2,4-triazol-4-yl)methyl)benzene
SMILES: N1(CC2=C(CN3N=CN=C3)C=CC=C2)N=CN=C1
Tpsa: 61.42
Logp: 0.9662
H Acceptors: 6
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:
C₁₂H₁₂N₆
Molecular Weight:
240.26
Synonyms:
1,2-bis((4H-1,2,4-triazol-4-yl)methyl)benzene
SMILES:
N1(CC2=C(CN3N=CN=C3)C=CC=C2)N=CN=C1
Tpsa:
61.42
Logp:
0.9662
H Acceptors:
6
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: C₃₀H₂₄O₉
Molecular Weight: 528.51
Synonyms: None
SMILES: O=C(C1=CC=C(C2=CC(C3=CC=C(C(OC)=C3)C(O)=O)=CC(C4=CC(OC)=C(C(O)=O)C=C4)=C2)C=C1OC)O
Tpsa: 139.59
Logp: 5.808
H Acceptors: 6
H Donors: 3
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₀H₂₄O₉
Molecular Weight:
528.51
Synonyms:
None
SMILES:
O=C(C1=CC=C(C2=CC(C3=CC=C(C(OC)=C3)C(O)=O)=CC(C4=CC(OC)=C(C(O)=O)C=C4)=C2)C=C1OC)O
Tpsa:
139.59
Logp:
5.808
H Acceptors:
6
H Donors:
3
Rotatable Bonds:
9
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₁₆N₆
Molecular Weight: 316.36
Synonyms: 4,4′-bis((1H-1,2,4-triazol-1-yl)methyl)biphenyl
SMILES: N1(CC2=CC=C(C3=CC=C(CN4N=CN=C4)C=C3)C=C2)N=CN=C1
Tpsa: 61.42
Logp: 2.6332
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₁₆N₆
Molecular Weight:
316.36
Synonyms:
4,4′-bis((1H-1,2,4-triazol-1-yl)methyl)biphenyl
SMILES:
N1(CC2=CC=C(C3=CC=C(CN4N=CN=C4)C=C3)C=C2)N=CN=C1
Tpsa:
61.42
Logp:
2.6332
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₉H₂₄O₆
Molecular Weight: 588.60
Synonyms: None
SMILES: O=C(C1=C2C=CC=CC2=C(C3=CC(C4=C5C=CC=CC5=C(C(O)=O)C=C4)=CC(C6=C7C=CC=CC7=C(C(O)=O)C=C6)=C3)C=C1)O
Tpsa: 111.9
Logp: 9.2418
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₉H₂₄O₆
Molecular Weight:
588.60
Synonyms:
None
SMILES:
O=C(C1=C2C=CC=CC2=C(C3=CC(C4=C5C=CC=CC5=C(C(O)=O)C=C4)=CC(C6=C7C=CC=CC7=C(C(O)=O)C=C6)=C3)C=C1)O
Tpsa:
111.9
Logp:
9.2418
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
6