Home > Compound List > Compound details
46006-95-5 molecular structure
click picture or here to close

2-(2,3-dihydro-1H-indol-1-yl)ethan-1-amine

ChemBase ID: 306700
Molecular Formular: C10H14N2
Molecular Mass: 162.23156
Monoisotopic Mass: 162.11569846
SMILES and InChIs

SMILES:
N1(c2c(CC1)cccc2)CCN
Canonical SMILES:
NCCN1CCc2c1cccc2
InChI:
InChI=1S/C10H14N2/c11-6-8-12-7-5-9-3-1-2-4-10(9)12/h1-4H,5-8,11H2
InChIKey:
HNLHKBSAQALACU-UHFFFAOYSA-N

Cite this record

CBID:306700 http://www.chembase.cn/molecule-306700.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2-(2,3-dihydro-1H-indol-1-yl)ethan-1-amine
IUPAC Traditional name
2-(2,3-dihydroindol-1-yl)ethanamine
Synonyms
2-(2,3-dihydro-1H-indol-1-yl)ethanamine
CAS Number
46006-95-5
MDL Number
MFCD03011731

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
ChemBridge 4003429 external link Add to cart
Data Source Data ID Price
ChemBridge
4003429 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) -1.673983  LogD (pH = 7.4) -0.82626426 
Log P 1.3241944  Molar Refractivity 51.746 cm3
Polarizability 19.5765 Å3 Polar Surface Area 29.26 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