AG003MXV

699-95-6 | 5-Norbornene-2-exo,3-exo-dimethanol

AG003MXV

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CAS Number	699-95-6
Catalog Number	AG003MXV(AGN-PC-0TXFGX)
Chemical Name	5-Norbornene-2-exo,3-exo-dimethanol
IUPAC Name	[(1R,2R,3S,4S)-3-(hydroxymethyl)-2-bicyclo[2.2.1]hept-5-enyl]methanol
InChI	InChI=1S/C9H14O2/c10-4-8-6-1-2-7(3-6)9(8)5-11/h1-2,6-11H,3-5H2/t6-,7+,8+,9-
InChI Key	IGHHPVIMEQGKNE-OJOKCITNSA-N
MDL Number	MFCD00799568
Molecular Formula	C9H14O2
Molecular Weight	154.2063
SMILES	OC[C@@H]1[C@H](C2)C=C[C@H]2[C@@H]1CO
Synonyms	5-Norbornene-2-exo,3-exo-dimethanol, 699-95-6, SCHEMBL1480357, IGHHPVIMEQGKNE-OJOKCITNSA-N, ZINC15855872, TL8004921, 5-Norbornene-2-exo,3-exo-dimethanol, 97%, (1beta,4beta)-Norborna-5-ene-2beta,3beta-dimethanol, (1R,2R,3S,4S)-bicyclo[2.2.1]hept-5-ene-2,3-diyldimethanol, NSC31985, CID11862151,

Complexity	158
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	4
Defined Bond Stereocenter Count	0
Exact Mass	154.099g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	154.209g/mol
Monoisotopic Mass	154.099g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	40.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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