Home > Compound List > Compound details
92520-16-6 molecular structure
click picture or here to close

N-[1-(4-bromophenyl)ethyl]acetamide

ChemBase ID: 311106
Molecular Formular: C10H12BrNO
Molecular Mass: 242.11238
Monoisotopic Mass: 241.01022601
SMILES and InChIs

SMILES:
N(C(=O)C)C(c1ccc(cc1)Br)C
Canonical SMILES:
CC(c1ccc(cc1)Br)NC(=O)C
InChI:
InChI=1S/C10H12BrNO/c1-7(12-8(2)13)9-3-5-10(11)6-4-9/h3-7H,1-2H3,(H,12,13)
InChIKey:
DRRCKKJEBGEBGR-UHFFFAOYSA-N

Cite this record

CBID:311106 http://www.chembase.cn/molecule-311106.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
N-[1-(4-bromophenyl)ethyl]acetamide
IUPAC Traditional name
N-[1-(4-bromophenyl)ethyl]acetamide
Synonyms
N-[1-(4-bromophenyl)ethyl]acetamide
CAS Number
92520-16-6
MDL Number
MFCD01123268

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
ChemBridge 5587422 external link Add to cart
Data Source Data ID Price
ChemBridge
5587422 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) 2.1031885  LogD (pH = 7.4) 2.1031885 
Log P 2.1031885  Molar Refractivity 56.0168 cm3
Polarizability 21.675207 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