1- (Hydroxymethyl) indan

CAT: 0127-OR471023Size: 1 gDry Ice: NoHazardous: No

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CAT#:0127-OR471023Size:1 g

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CAS Number

1196-17-4

MDL Number

MFCD18089511

Purity

95%

Smiles

OCC1CCc2ccccc12

Chemical Information

1-Indanmethanol

CAS Number	1196-17-4
PubChem CID	271880
IUPAC Name	2,3-dihydro-1H-inden-1-ylmethanol
Molecular Formula	C10H12O
Molecular Weight	148.20
XLogP	1.7
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	11
Formal Charge	0
Complexity	133

SMILES

C1CC2=CC=CC=C2C1CO

InChI

InChI=1S/C10H12O/c11-7-9-6-5-8-3-1-2-4-10(8)9/h1-4,9,11H,5-7H2

InChIKey

GJZQCDPVYVQVBP-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1196-17-4

CID: 271880

Formula: C10H12O

MW: 148.20

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	148.20
XLogP3	1.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	148.088815002
Monoisotopic Mass	148.088815002
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	133
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR6561-01	Indan-1-one
OR26239	Indan-1-one oxime
PC51093-01	4- (Trifluoromethyl) indan-1-one
OR938861-01	1-Indan-4-yl-ethanone
OR12575	Cis-Indan-1,3-diol
OR938865-01	3- (Dicyanomethylidene) indan-1-one
OR91045-01	1,3-Bis (dicyanomethylidene) indan
PC01481	4- (Difluoromethoxy) indan-1-one
PC8805-01	5- (Trifluoromethyl) indan-1-one
OR30508-01	Indan-2-one