Name: Name:(1S)-1-(adamantan-1-yl)ethan-1-ol
Brand: Angene
SKU: AG01EMEB
Rating: 90 (10 reviews)

(1S)-1-(adamantan-1-yl)ethan-1-ol

CAS No.:

138309-12-3

Catalog Number:

AG01EMEB

Molecular Formula:

C12H20O

Molecular Weight:

180.2866

Catalog Number:

AG01EMEB

Chemical Name:

(1S)-1-(adamantan-1-yl)ethan-1-ol

CAS Number:

138309-12-3

Molecular Formula:

C12H20O

Molecular Weight:

180.2866

MDL Number:

MFCD14705941

IUPAC Name:

(1S)-1-(1-adamantyl)ethanol

InChI:

InChI=1S/C12H20O/c1-8(13)12-5-9-2-10(6-12)4-11(3-9)7-12/h8-11,13H,2-7H2,1H3/t8-,9?,10?,11?,12?/m0/s1

InChI Key:

YALBLVPSPRKDJI-JKJWBTBISA-N

SMILES:

C[C@@H](C12CC3CC(C2)CC(C1)C3)O

Complexity:

180

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

180.151g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

180.291g/mol

Monoisotopic Mass:

180.151g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

20.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.9