AG000OJR

18776-12-0 | Benzenemethanol, α-(2-chloroethyl)-

AG000OJR

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CAS Number	18776-12-0
Catalog Number	AG000OJR(AGN-PC-008LNA)
Chemical Name	Benzenemethanol, α-(2-chloroethyl)-
EC Number	606-122-6
IUPAC Name	3-chloro-1-phenylpropan-1-ol
InChI	InChI=1S/C9H11ClO/c10-7-6-9(11)8-4-2-1-3-5-8/h1-5,9,11H,6-7H2
InChI Key	JZFUHAGLMZWKTF-UHFFFAOYSA-N
MDL Number	MFCD09878800
Molecular Formula	C9H11ClO
Molecular Weight	170.6360
SMILES	ClCCC(O)C1=CC=CC=C1
Synonyms	3-chloro-1-phenyl-propanol, 3-chloro-1-phenylpropanol, 3-chloro-1-phenylpropan-1-ol, 18776-12-0, 3-Chloro-1-phenyl-1-propanol, 3-Chloro-1-phenyl-propanol, 3-chloro-1-phenylpropanol, 3-Chloro-1-phenyl-propan-1-ol, AK-40050, (R)-3-Chloro-1-phenyl-1-propanol, PubChem14094, AC1LC9IA, AC1Q3UHX, ACMC-2097ok, ACMC-2097ol, KSC497I3F, SCHEMBL525669, rac 3-Chloro-1-phenylpropanol, 1-Phenyl-3-chloro-1-propanol, CTK3J7432, DTXSID80341286, JZFUHAGLMZWKTF-UHFFFAOYSA-N, R(+)-3-chloro-1-phenylpropanol, ACT09179, ALBB-004119, BCP12491, BCP15449, ZX-AN004088, alpha-(2-Chloroethyl)benzyl alcohol, ANW-50154, FCH831805, MFCD09878800, STK502931, (-)-3-Chloro-1-phenyl-1-propanol, AKOS000321631, AKOS016342130, racemic 3-chloro-1-phenyl-1-propanol, AN-9827, CS-W019837, RTR-033416, TRA0004700, TRA0034997, (R )-(+)-3-chloro-1-phenylpropanol, ACM18776120, KS-0000090X, benzenemethanol, alpha-(2-chloroethyl)-, AK-25234, AK-31989, BR-40050, DS-13210, SC-00015, SC-47390, SY021621, SY021625, SY021671, AB0005567, AX8085546, ST2410598, TR-033416, 4CH-007016, 4CH-015521, BB 0240838, FT-0664923, W4052, MFCD00013309 (98%), MFCD00075128 (98%), MFCD09878800 (95%), A23534, EN300-154529, S-1828, 776C120, I01-0851, J-012087, C9H11ClO, (S)-3-Chloro-1-phenylpropan-1-ol, (R)-3-chloro-1-phenylpropan-1-ol, |A-(2-Chloroethyl)benzenemethanol, (S)-3-Chloro-1-phenyl-1-propanol, |A-(2-Chloroethyl)benzyl Alcohol, (1R)-3-Chloro-1-phenyl-propan-1-ol, AR-1F2485, CID572064, ZINC00160291, (R)-(+)-3-Chloro-1-phenylpropanol, 100306-33-0, (S)-(-)-3-Chloro-1-phenyl-1-propanol, CB10123, C175, 100306-34-1, C2904, A16167, 18877-91-3,

Complexity	99.7
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	170.05g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	170.636g/mol
Monoisotopic Mass	170.05g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number