CS-0133946
2-(6-Acetylpyridin-2-yl)-2,3-dihydrobenzo[d][1,3,2]diazaborinin-4(1H)-one
Manufacturer: ChemScene
CAS Number: 2242502-33-4
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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
C₁₄H₁₂BN₃O₂
Molecular Weight
265.07
Synonyms
None
SMILES
O=C1NB(C2=NC(C(C)=O)=CC=C2)NC3=CC=CC=C31
Tpsa
71.09
Logp
0.8349
H Acceptors
4
H Donors
2
Rotatable Bonds
2
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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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₂BN₃O₂
Molecular Weight: 265.07
Synonyms: None
SMILES: O=C1NB(C2=NC(C(C)=O)=CC=C2)NC3=CC=CC=C31
Tpsa: 71.09
Logp: 0.8349
H Acceptors: 4
H Donors: 2
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:
C₁₄H₁₂BN₃O₂
Molecular Weight:
265.07
Synonyms:
None
SMILES:
O=C1NB(C2=NC(C(C)=O)=CC=C2)NC3=CC=CC=C31
Tpsa:
71.09
Logp:
0.8349
H Acceptors:
4
H Donors:
2
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: C₁₁H₁₆O₃
Molecular Weight: 196.24
Synonyms: 1,4-Dioxaspiro[4.5]dec-6-en-8-one, 7,9,9-trimethyl-
SMILES: O=C(C(C)(C)C1)C(C)=CC21OCCO2
Tpsa: 35.53
Logp: 1.6748
H Acceptors: 3
H Donors: 0
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:
C₁₁H₁₆O₃
Molecular Weight:
196.24
Synonyms:
1,4-Dioxaspiro[4.5]dec-6-en-8-one, 7,9,9-trimethyl-
SMILES:
O=C(C(C)(C)C1)C(C)=CC21OCCO2
Tpsa:
35.53
Logp:
1.6748
H Acceptors:
3
H Donors:
0
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: C₁₄H₁₂BN₃O₃
Molecular Weight: 281.07
Synonyms: None
SMILES: O=C(C1=NC(B2NC(C3=C(N2)C=CC=C3)=O)=CC=C1)OC
Tpsa: 80.32
Logp: 0.4189
H Acceptors: 5
H Donors: 2
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:
C₁₄H₁₂BN₃O₃
Molecular Weight:
281.07
Synonyms:
None
SMILES:
O=C(C1=NC(B2NC(C3=C(N2)C=CC=C3)=O)=CC=C1)OC
Tpsa:
80.32
Logp:
0.4189
H Acceptors:
5
H Donors:
2
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: C₁₀H₁₄O₃
Molecular Weight: 182.22
Synonyms: 1-(4-OXOCYCLOHEXYL)CYCLOPROPANECARBOXYLIC ACID(WXC08042)
SMILES: O=C(C1(C2CCC(CC2)=O)CC1)O
Tpsa: 54.37
Logp: 1.6105
H Acceptors: 2
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:
C₁₀H₁₄O₃
Molecular Weight:
182.22
Synonyms:
1-(4-OXOCYCLOHEXYL)CYCLOPROPANECARBOXYLIC ACID(WXC08042)
SMILES:
O=C(C1(C2CCC(CC2)=O)CC1)O
Tpsa:
54.37
Logp:
1.6105
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2