CS-0768855
(1-(3-(Dimethylamino)Propyl)-1H-pyrazol-4-yl)boronic acid
Manufacturer: ChemScene
CAS Number: 847818-60-4
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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
C₈H₁₆BN₃O₂
Molecular Weight
197.04
Synonyms
None
SMILES
CN(C)CCCN1C=C(C=N1)B(O)O
Tpsa
61.52
Logp
-1.4854
H Acceptors
5
H Donors
2
Rotatable Bonds
5
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: C₈H₁₆BN₃O₂
Molecular Weight: 197.04
Synonyms: None
SMILES: CN(C)CCCN1C=C(C=N1)B(O)O
Tpsa: 61.52
Logp: -1.4854
H Acceptors: 5
H Donors: 2
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:
C₈H₁₆BN₃O₂
Molecular Weight:
197.04
Synonyms:
None
SMILES:
CN(C)CCCN1C=C(C=N1)B(O)O
Tpsa:
61.52
Logp:
-1.4854
H Acceptors:
5
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: C₈H₁₂ClNO
Molecular Weight: 173.64
Synonyms: None
SMILES: Cl.CC(ON)C1=CC=CC=C1
Tpsa: 35.25
Logp: 2.0597
H Acceptors: 2
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:
C₈H₁₂ClNO
Molecular Weight:
173.64
Synonyms:
None
SMILES:
Cl.CC(ON)C1=CC=CC=C1
Tpsa:
35.25
Logp:
2.0597
H Acceptors:
2
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: C₁₁H₁₃Cl₂NO
Molecular Weight: 246.13
Synonyms: None
SMILES: ClC1=CC(Cl)=C(CO[C@@H]2CCNC2)C=C1
Tpsa: 21.26
Logp: 2.8719
H Acceptors: 2
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:
C₁₁H₁₃Cl₂NO
Molecular Weight:
246.13
Synonyms:
None
SMILES:
ClC1=CC(Cl)=C(CO[C@@H]2CCNC2)C=C1
Tpsa:
21.26
Logp:
2.8719
H Acceptors:
2
H Donors:
1
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: C₁₅H₁₁ClF₃NO₄
Molecular Weight: 361.70
Synonyms: None
SMILES: C[C@H](OC1=CC=C(OC2=C(Cl)C=C(C=N2)C(F)(F)F)C=C1)C(O)=O
Tpsa: 68.65
Logp: 4.398
H Acceptors: 4
H Donors: 1
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:
C₁₅H₁₁ClF₃NO₄
Molecular Weight:
361.70
Synonyms:
None
SMILES:
C[C@H](OC1=CC=C(OC2=C(Cl)C=C(C=N2)C(F)(F)F)C=C1)C(O)=O
Tpsa:
68.65
Logp:
4.398
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
5