AG003P4V

931-97-5 | 1-HYDROXY-1-CYCLOHEXANECARBONITRILE

AG003P4V

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CAS Number	931-97-5
Catalog Number	AG003P4V(AGN-PC-0WAL17)
Chemical Name	1-HYDROXY-1-CYCLOHEXANECARBONITRILE
EC Number	213-246-0
IUPAC Name	1-hydroxycyclohexane-1-carbonitrile
InChI	InChI=1S/C7H11NO/c8-6-7(9)4-2-1-3-5-7/h9H,1-5H2
InChI Key	ZDBRPNZOTCHLSP-UHFFFAOYSA-N
MDL Number	MFCD00003818
Molecular Formula	C7H11NO
Molecular Weight	125.1683
SMILES	N#CC1(O)CCCCC1
UN Number	2811
UNII	ON43942N5P
Synonyms	Cyclohexanone cyanohydrin, 1-Hydroxycyclohexanecarbonitrile, 931-97-5, 1-Hydroxy-1-cyclohexanecarbonitrile, Cyclohexanone, cyanohydrin, 1-Cyano-1-hydroxycyclohexane, Cyclohexanecarbonitrile, 1-hydroxy-, 1-Hydroxy-cyclohexanecarbonitrile, NSC 14493, NSC 52190, UNII-ON43942N5P, CCRIS 4608, EINECS 213-246-0, BRN 1634973, AI3-37039, ZDBRPNZOTCHLSP-UHFFFAOYSA-N, ON43942N5P, 1-hydroxycyclohexane-1-carbonitrile, Cyclohexanoncyanhydrin, cyclohexanone cyanhydrin, DSSTox_CID_4878, DSSTox_RID_77562, DSSTox_GSID_24878, SCHEMBL18010, 1-Hydroxy-1-cyanocyclohexane, 4-10-00-00021 (Beilstein Handbook Reference), AC1L223C, AC1Q77Y9, Cyclohexanone cyanohydrin, 98%, CHEMBL1569015, DTXSID2024878, ALBB-032350, NSC14493, NSC52190, ZINC8681667, 1-oxidanylcyclohexane-1-carbonitrile, Tox21_200377, 1-hydroxy-cyclohexane-1-carbonitrile, MFCD00003818, NSC-14493, NSC-52190, AKOS009157962, EBD3073298, LS-1952, MCULE-5791427313, NCGC00091113-01, NCGC00091113-02, NCGC00257931-01, AC-18710, CAS-931-97-5, DB-057379, FT-0633129, ST51038182, A844473, I14-21569, 1-Hydroxycycloheptanecarbonitrile, C7H11NO, C7-H11-N-O, CID13610, CYCLOHEXANONE CYANOHYDRIN; 1-HYDROXY-1-CYANOCYCLOHEXANE; 1-CYANO-1-HYDROXYCYCLOHEXANE; 1-HYDROXY-CYCLOHEXANCARBONITRIL; 1-HYDROXY-CYCLOHEXANECARBONITRIL; 1-HYDROXY-CYCLOHEXANECARBONITRILE; CYCLOHEXANECARBONITRILE,1-HYDROXY-; 1-HYDROXYCYCLOHEXANE-1-CARBONITRILE; 1-HYDROXY-1-CYCLOHEXANECARBONITRILE,

Complexity	138
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	125.084g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	125.171g/mol
Monoisotopic Mass	125.084g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	44A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H300
Precuationary statements	P264-P301+P310
Siginal words

Certificate of Analysis

Lot Number