Cas no 324528-81-6 (Benzamide, 2-amino-3-bromo-5-methyl-)
324528-81-6 structure
Product Name:Benzamide, 2-amino-3-bromo-5-methyl-
CAS No:324528-81-6
MF:C8H9BrN2O
MW:229.073860883713
CID:1451722
PubChem ID:58828874
Update Time:2025-04-20
Benzamide, 2-amino-3-bromo-5-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzamide, 2-amino-3-bromo-5-methyl-
- PSNWXRVFCMRKQW-UHFFFAOYSA-N
- 2-amino-3-bromo-5-methylbenzamide
- DA-06894
- 324528-81-6
- SCHEMBL2379171
-
- Inchi： 1S/C8H9BrN2O/c1-4-2-5(8(11)12)7(10)6(9)3-4/h2-3H,10H2,1H3,(H2,11,12)
- InChI Key： PSNWXRVFCMRKQW-UHFFFAOYSA-N
- SMILES： BrC1=CC(C)=CC(C(N)=O)=C1N
Computed Properties
- Exact Mass: 227.98987
- Monoisotopic Mass: 227.99
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 186
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 69.1A^2
- XLogP3: 1.7
Experimental Properties
- PSA: 69.11
Benzamide, 2-amino-3-bromo-5-methyl- Related Literature
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
-
Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
-
Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
-
Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
-
Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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