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Phenol, 2-amino-4-bromo-5-methyl-
CAS:
848358-81-6
MW:
202.051
MF:
C7H8BrNO
 
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Namen und Bezeichner
Eigenschaften
SDB-Informationen
Computerchemische Daten
Realisierte Produktinformationen
1. Namen und Bezeichner
1.1 Produktname
Phenol, 2-amino-4-bromo-5-methyl-
1.2 Synonyme
2-amino-4-bromo-5-methylphenol;
1.3 CAS No.
848358-81-6
1.4 CID
20251686
1.5 Summenformel
C7H8BrNO
1.6 Inchi
InChI=1S/C7H8BrNO/c1-4-2-7(10)6(9)3-5(4)8/h2-3,10H,9H2,1H3
1.7 InchiKey
OVFOSMHDFYXTCQ-UHFFFAOYSA-N
1.8 Kanonisch SMILES
CC1=CC(=C(C=C1Br)N)O
1.9 Isomere SMILES
CC1=CC(=C(C=C1Br)N)O
2. Eigenschaften
2.1 pKa
9.31±0.23(Predicted)
3. SDB-Informationen
2.
Hazard identification
2.1
Classification of the substance or mixture
no data available
2.2
GHS label elements, including precautionary statements
Pictogram(s)
no data available
Signal word
no data available
Hazard statement(s)
no data available
Precautionary statement(s)
Prevention
no data available
Response
no data available
Storage
no data available
Disposal
no data available
2.3
Other hazards which do not result in classification
no data available
Alle anzeigen
4. Synthetischer Weg.
848358-81-6
Total: 2 Synthetischer Weg.
700-38-9
66 Lieferanten
848358-81-6
14 Lieferanten
182500-28-3
14 Lieferanten
848358-81-6
14 Lieferanten
5. Vorläufer und Produkt
Vorläufer:
700-38-9
182500-28-3
6. Computerchemische Daten
Molecular Weight:
202.051g/mol
Molecular Formula:
C
7
H
8
BrNO
Compound Is Canonicalized:
True
Exact Mass:
1.9
XLogP3-AA:
200.97893
Monoisotopic Mass:
200.97893
Complexity:
120
Rotatable Bond Count:
0
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Topological Polar Surface Area:
46.2
Heavy Atom Count::
10
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Isotope Atom Count:
0
Covalently-Bonded Unit Count:
1
CACTVS Substructure Key Fingerprint:
AAADccBiIAAAEAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAHgBQCAABrAyBmAAyxoBAAgCAAiRCQACCAAAgIgQAiAAHbKgKJiKSkZOAcABk0BEI2heQwBAOCBABAAEAkAAQIAIAAgEgAAAAAAAAAA==
7. Toltal 13 Lieferanten
Mehr anzeigen
Hubei Jiutian Bio-medical Technology Co., Ltd
1YR
Tel:
Update Time:
2024/09/17
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Shanghai Forever Synthesis Co.,Ltd.
Tel:
Update Time:
2019/06/12
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Finetech Industry limited.
Tel:
Update Time:
2018/11/21
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SHANGHAI ZZBIO CO., LTD.
Tel:
Update Time:
2019/02/23
inquire
Shang Hai Grade Biochemical Co,. Limited
Tel:
Update Time:
2019/02/25
inquire
8. Realisierte Produktinformationen
2-amino-5-bromo-4-methylphenol
cas:1268153-80-5
2-amino-4-bromo-3-methylphenol
cas:1154740-46-1
4-Bromo-3-methylphenol
cas:14472-14-1
2-Bromo-4-methylphenol
cas:6627-55-0
4-Bromo-2-methylphenol
cas:2362-12-1
5-Bromo-2-methylphenol
cas:36138-76-8
1. Namen und Bezeichner
1.1 Produktname
1.2 Synonyme
1.3 CAS No.
1.4 Summenformel
1.5 Inchi
1.6 InchiKey
1.7 Kanonisch SMILES
1.8 Isomere SMILES
2. Eigenschaften
2.1 pKa
3.
SDB-Informationen
4.
Synthetischer Weg.
5.
Vorläufer und Produkt
6.
Computerchemische Daten
7.
Toltal 13 Lieferanten
8.
Realisierte Produktinformationen
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