Home > Compound List > Compound details
337535-74-7 molecular structure
click picture or here to close

3-bromo-N-cyclopropylbenzamide

ChemBase ID: 311917
Molecular Formular: C10H10BrNO
Molecular Mass: 240.0965
Monoisotopic Mass: 238.99457595
SMILES and InChIs

SMILES:
C(=O)(NC1CC1)c1cc(Br)ccc1
Canonical SMILES:
Brc1cccc(c1)C(=O)NC1CC1
InChI:
InChI=1S/C10H10BrNO/c11-8-3-1-2-7(6-8)10(13)12-9-4-5-9/h1-3,6,9H,4-5H2,(H,12,13)
InChIKey:
TZOROVSHSRTGHY-UHFFFAOYSA-N

Cite this record

CBID:311917 http://www.chembase.cn/molecule-311917.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
3-bromo-N-cyclopropylbenzamide
IUPAC Traditional name
3-bromo-N-cyclopropylbenzamide
Synonyms
3-bromo-N-cyclopropylbenzamide
CAS Number
337535-74-7
MDL Number
MFCD03387330

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
ChemBridge 7223774 external link Add to cart
Data Source Data ID Price
ChemBridge
7223774 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) 2.2818792  LogD (pH = 7.4) 2.2818794 
Log P 2.2818794  Molar Refractivity 54.8671 cm3
Polarizability 20.775963 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