AG003P47

4448-75-3 | Cycloheptanemethanol

AG003P47

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COA

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CAS Number	4448-75-3
Catalog Number	AG003P47(AGN-PC-0JLR7A)
Chemical Name	Cycloheptanemethanol
EC Number	224-691-5
IUPAC Name	cycloheptylmethanol
InChI	InChI=1S/C8H16O/c9-7-8-5-3-1-2-4-6-8/h8-9H,1-7H2
InChI Key	BMCQFFXPECPDPS-UHFFFAOYSA-N
MDL Number	MFCD00004154
Molecular Formula	C8H16O
Molecular Weight	128.2120
SMILES	C1(CCCCCC1)CO
Synonyms	Cycloheptanemethanol, Cycloheptylmethanol, 4448-75-3, (HYDROXYMETHYL)CYCLOHEPTANE, BMCQFFXPECPDPS-UHFFFAOYSA-N, cycloheptyl-methanol, EINECS 224-691-5, Cycloheptylmethanol #, PubChem16220, AC1L2UOY, ACMC-1AI6G, AC1Q7C9A, CYCLOHEPTANE METHANOL, SCHEMBL330190, BMCQFFXPECPDPS-UHFFFAOYSA-, CTK1D6687, DTXSID30196187, KS-000001SZ, ZINC5184936, MFCD00004154, AKOS011881794, MCULE-1749370417, NE57589, TRA0001968, CJ-12504, SC-12449, AB0066602, DB-051225, TC-010713, FT-0635302, Z1998854165, InChI=1/C8H16O/c9-7-8-5-3-1-2-4-6-8/h8-9H,1-7H2, CYCLOHEPTANE, C8-H16-O, CID78193, AR-1I2897, methyl 5-bromo-4-methoxy-2-methylbenzoate, 10139-47-6, 1131587-94-4, 479-81-2,

Complexity	63
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	128.12g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	128.215g/mol
Monoisotopic Mass	128.12g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

Lot Number