Home > Compound List > Compound details
7160-08-9 molecular structure
click picture or here to close

N-(4-bromophenyl)-2-methylpropanamide

ChemBase ID: 310816
Molecular Formular: C10H12BrNO
Molecular Mass: 242.11238
Monoisotopic Mass: 241.01022601
SMILES and InChIs

SMILES:
C(=O)(Nc1ccc(Br)cc1)C(C)C
Canonical SMILES:
CC(C(=O)Nc1ccc(cc1)Br)C
InChI:
InChI=1S/C10H12BrNO/c1-7(2)10(13)12-9-5-3-8(11)4-6-9/h3-7H,1-2H3,(H,12,13)
InChIKey:
AVQYIQZFJLEKGK-UHFFFAOYSA-N

Cite this record

CBID:310816 http://www.chembase.cn/molecule-310816.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
N-(4-bromophenyl)-2-methylpropanamide
IUPAC Traditional name
N-(4-bromophenyl)-2-methylpropanamide
Synonyms
N-(4-bromophenyl)-2-methylpropanamide
CAS Number
7160-08-9
MDL Number
MFCD00774531

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
ChemBridge 5522659 external link Add to cart
Data Source Data ID Price
ChemBridge
5522659 external link Add to cart Please log in.
Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 3.2232308  LogD (pH = 7.4) 3.2232308 
Log P 3.2232308  Molar Refractivity 57.7452 cm3
Polarizability 21.66752 Å3 Polar Surface Area 29.1 Å2

PROPERTIES

PROPERTIES

Bioassay(PubChem)

DETAILS

DETAILS

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
    No data available
  • Searching...Please wait...

PATENTS

PATENTS

PubChem iconPubChem Patent Google Patent Search IconGoogle Patent

INTERNET

INTERNET

Baidu iconBaidu google iconGoogle