CS-0530850
5-Bromo-8-hydroxy-3-methylisochroman-1-one
Manufacturer: ChemScene
CAS Number: 885679-60-7
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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
C₁₀H₉BrO₃
Molecular Weight
257.08
Synonyms
None
SMILES
O=C1OC(CC2=C1C(O)=CC=C2Br)C
Tpsa
46.53
Logp
2.2561
H Acceptors
3
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
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: C₁₀H₉BrO₃
Molecular Weight: 257.08
Synonyms: None
SMILES: O=C1OC(CC2=C1C(O)=CC=C2Br)C
Tpsa: 46.53
Logp: 2.2561
H Acceptors: 3
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:
C₁₀H₉BrO₃
Molecular Weight:
257.08
Synonyms:
None
SMILES:
O=C1OC(CC2=C1C(O)=CC=C2Br)C
Tpsa:
46.53
Logp:
2.2561
H Acceptors:
3
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: C₁₃H₁₆BrNO₃
Molecular Weight: 314.18
Synonyms: tert-Butyl 8-bromo-2,3-dihydro-1,4-benzoxazine-4-carboxylate
SMILES: O=C(N1C2=C(OCC1)C(Br)=CC=C2)OC(C)(C)C
Tpsa: 38.77
Logp: 3.583
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:
C₁₃H₁₆BrNO₃
Molecular Weight:
314.18
Synonyms:
tert-Butyl 8-bromo-2,3-dihydro-1,4-benzoxazine-4-carboxylate
SMILES:
O=C(N1C2=C(OCC1)C(Br)=CC=C2)OC(C)(C)C
Tpsa:
38.77
Logp:
3.583
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: C₁₃H₁₄N₂O₅
Molecular Weight: 278.26
Synonyms: 4-[({[4-(2-Hydroxyethyl)-1H-pyrrol-3-yl]carbonyl}oxy)methyl]-1H-p yrrole-3-carboxylic acid
SMILES: O=C(C1=CNC=C1COC(C2=CNC=C2CCO)=O)O
Tpsa: 115.41
Logp: 0.9328
H Acceptors: 4
H Donors: 4
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:
C₁₃H₁₄N₂O₅
Molecular Weight:
278.26
Synonyms:
4-[({[4-(2-Hydroxyethyl)-1H-pyrrol-3-yl]carbonyl}oxy)methyl]-1H-p yrrole-3-carboxylic acid
SMILES:
O=C(C1=CNC=C1COC(C2=CNC=C2CCO)=O)O
Tpsa:
115.41
Logp:
0.9328
H Acceptors:
4
H Donors:
4
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: C₁₀H₁₂BrN
Molecular Weight: 226.11
Synonyms: 8-Bromo-1-methyl-1,2,3,4-tetrahydro-quinoline
SMILES: BrC1=CC=CC2=C1N(CCC2)C
Tpsa: 3.24
Logp: 2.8315
H Acceptors: 1
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:
C₁₀H₁₂BrN
Molecular Weight:
226.11
Synonyms:
8-Bromo-1-methyl-1,2,3,4-tetrahydro-quinoline
SMILES:
BrC1=CC=CC2=C1N(CCC2)C
Tpsa:
3.24
Logp:
2.8315
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
0