Name: Name:decahydrocyclohepta[c]pyrrole, Mixture of diastereomers
Brand: Angene
SKU: AG01EJ1Z
Rating: 90 (10 reviews)

decahydrocyclohepta[c]pyrrole, Mixture of diastereomers

CAS No.:

110421-28-8

Catalog Number:

AG01EJ1Z

Molecular Formula:

C9H17N

Molecular Weight:

139.2380

Catalog Number:

AG01EJ1Z

Chemical Name:

decahydrocyclohepta[c]pyrrole, Mixture of diastereomers

CAS Number:

110421-28-8

Molecular Formula:

C9H17N

Molecular Weight:

139.2380

MDL Number:

MFCD24496438

IUPAC Name:

1,2,3,3a,4,5,6,7,8,8a-decahydrocyclohepta[c]pyrrole

InChI:

InChI=1S/C9H17N/c1-2-4-8-6-10-7-9(8)5-3-1/h8-10H,1-7H2

InChI Key:

CLGNZNKTKHGQJT-UHFFFAOYSA-N

SMILES:

C1CCC2C(CC1)CNC2

Complexity:

99.3

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

139.136g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

139.242g/mol

Monoisotopic Mass:

139.136g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

12A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.2